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emSynthesis
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emical database
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Chemical Name
Cas Number
EINECS Number
MDL Number
Molecular Formula
InChIKey
Smiles
Journal Title
GO
Canadian Journal of Chemistry
Cyclohexyl bromide
Molecular Formula:
C
6
H
11
Br
Molecular Weight:
163.057 g/mol
Cas Number:
108-85-0
EINECS Number:
203-622-2
4-Bromoacetanilide
Molecular Formula:
C
8
H
8
BrNO
Molecular Weight:
214.062 g/mol
Cas Number:
103-88-8
EINECS Number:
203-154-9
1-iodo-1-octyne
Molecular Formula:
C
8
H
13
I
Molecular Weight:
236.096 g/mol
Cas Number:
81438-46-2
EINECS Number:
-
1,2,3,4,5,6,7,8-octahydroacridine
Molecular Formula:
C
13
H
17
N
Molecular Weight:
187.285 g/mol
Cas Number:
1658-08-8
EINECS Number:
-
2-Bromo-2'-nitroacetophenone
Molecular Formula:
C
8
H
6
BrNO
3
Molecular Weight:
244.045 g/mol
Cas Number:
6851-99-6
EINECS Number:
-
o-Nitrostyrene oxide
Molecular Formula:
C
8
H
7
NO
3
Molecular Weight:
165.149 g/mol
Cas Number:
39830-70-1
EINECS Number:
-
1-phenyl-2,5-pyrrolidinedione
Molecular Formula:
C
10
H
9
NO
2
Molecular Weight:
175.187 g/mol
Cas Number:
83-25-0
EINECS Number:
-
Phenyl benzoate
Molecular Formula:
C
13
H
10
O
2
Molecular Weight:
198.221 g/mol
Cas Number:
93-99-2
EINECS Number:
202-293-2
N,N,N-triphenylamine
Molecular Formula:
C
18
H
15
N
Molecular Weight:
245.324 g/mol
Cas Number:
603-34-9
EINECS Number:
210-035-5
Cyclohexanone dimethyl ketal
Molecular Formula:
C
8
H
16
O
2
Molecular Weight:
144.214 g/mol
Cas Number:
933-40-4
EINECS Number:
-
2-Nitrostyrene glycol
Molecular Formula:
C
8
H
9
NO
4
Molecular Weight:
183.164 g/mol
Cas Number:
51673-59-7
EINECS Number:
-
3-(1-hydroxyethyl)-4-vinyl-2-azetidinone
Molecular Formula:
C
7
H
11
NO
2
Molecular Weight:
141.17 g/mol
Cas Number:
-
EINECS Number:
-
3-iodo-4-vinyl-2-azetidinone
Molecular Formula:
C
5
H
6
INO
Molecular Weight:
223.013 g/mol
Cas Number:
-
EINECS Number:
-
1-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-2-naphthalenyl)ethanone
Molecular Formula:
C
14
H
16
O
4
Molecular Weight:
248.279 g/mol
Cas Number:
-
EINECS Number:
-
methyl 5-hydroxy-3-oxo-5-phenylpentanoate
Molecular Formula:
C
12
H
14
O
4
Molecular Weight:
222.241 g/mol
Cas Number:
-
EINECS Number:
-
6,6-dimethyl-tetrahydro-pyran-2,4-dione
Molecular Formula:
C
7
H
10
O
3
Molecular Weight:
142.155 g/mol
Cas Number:
-
EINECS Number:
-
methyl 6-chloro-5-methoxy-3-oxohexanoate
Molecular Formula:
C
8
H
13
ClO
4
Molecular Weight:
208.642 g/mol
Cas Number:
-
EINECS Number:
-
Methyl Salicylate
Molecular Formula:
C
8
H
8
O
3
Molecular Weight:
152.15 g/mol
Cas Number:
119-36-8
EINECS Number:
204-317-7
dimethyl 3,6-dioxooctanedioate
Molecular Formula:
C
10
H
14
O
6
Molecular Weight:
230.218 g/mol
Cas Number:
-
EINECS Number:
-
methyl 2-(2-methoxy-2-oxoethyl)-5-oxo-1-cyclopentene-1-carboxylate
Molecular Formula:
C
10
H
12
O
5
Molecular Weight:
212.202 g/mol
Cas Number:
-
EINECS Number:
-
3,3,12-trimethyl-2,4,11,13-tetraoxapentadec-6-yn-9-ol
Molecular Formula:
C
14
H
26
O
5
Molecular Weight:
274.357 g/mol
Cas Number:
-
EINECS Number:
-
1-[(1-ethoxyethoxy)methyl]-5-hydroxy-3-pentynyl acetate
Molecular Formula:
C
12
H
20
O
5
Molecular Weight:
244.288 g/mol
Cas Number:
-
EINECS Number:
-
methyl (5Z,8Z)-11-(acetyloxy)-12-hydroxy-5,8-dodecadienoate
Molecular Formula:
C
15
H
24
O
5
Molecular Weight:
284.353 g/mol
Cas Number:
-
EINECS Number:
-
methyl (5Z,8Z)-11-(acetyloxy)-12-oxo-5,8-dodecadienoate
Molecular Formula:
C
15
H
22
O
5
Molecular Weight:
282.337 g/mol
Cas Number:
-
EINECS Number:
-
9,10-dihydrophenanthrene
Molecular Formula:
C
14
H
12
Molecular Weight:
180.249 g/mol
Cas Number:
776-35-2
EINECS Number:
212-278-2
1-methyl-7-oxoheptyl acetate
Molecular Formula:
C
10
H
18
O
3
Molecular Weight:
186.251 g/mol
Cas Number:
-
EINECS Number:
-
2-[[methyl-(2,4,6-trimethyl-phenyl)-amino]-methyl]-cyclohexan-1-one
Molecular Formula:
C
17
H
25
NO
Molecular Weight:
259.392 g/mol
Cas Number:
-
EINECS Number:
-
4,4,5-trimethyl-6,8-dioxa-3-thiabicyclo[3.2.1]octane
Molecular Formula:
C
8
H
14
O
2
S
Molecular Weight:
174.264 g/mol
Cas Number:
-
EINECS Number:
-
ethyl [(2E)-3-(4-cyanophenyl)-2-triazenyl]acetate
Molecular Formula:
C
11
H
12
N
4
O
2
Molecular Weight:
232.242 g/mol
Cas Number:
-
EINECS Number:
-
4-(5-hydroxy-1H-1,2,3-triazol-1-yl)benzonitrile
Molecular Formula:
C
9
H
6
N
4
O
Molecular Weight:
186.173 g/mol
Cas Number:
-
EINECS Number:
-
N-(4-cyanophenyl)-2-diazoacetamide
Molecular Formula:
C
9
H
6
N
4
O
Molecular Weight:
186.173 g/mol
Cas Number:
-
EINECS Number:
-
2-Benzoylpyrrole
Molecular Formula:
C
11
H
9
NO
Molecular Weight:
171.199 g/mol
Cas Number:
7697-46-3
EINECS Number:
-
2,2-bis(ethylsulfanyl)propanenitrile
Molecular Formula:
C
7
H
13
NS
2
Molecular Weight:
175.319 g/mol
Cas Number:
-
EINECS Number:
-
2-methyl-1,2,3,4,5,6,7,8-octahydro-indolizine-8a-carbonitrile
Molecular Formula:
C
10
H
16
N
2
Molecular Weight:
164.251 g/mol
Cas Number:
-
EINECS Number:
-
4-nitrophenyl 7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
Molecular Formula:
C
13
H
10
N
2
O
5
Molecular Weight:
274.233 g/mol
Cas Number:
-
EINECS Number:
-
2-Methyl-6-nitro-1-benzofuran
Molecular Formula:
C
9
H
7
NO
3
Molecular Weight:
177.16 g/mol
Cas Number:
87977-31-9
EINECS Number:
-
Pyrrole-2-carboxaldehyde
Molecular Formula:
C
5
H
5
NO
Molecular Weight:
95.101 g/mol
Cas Number:
1003-29-8
EINECS Number:
213-705-5
4-(2-hydroxyethyl)-1,1-dimethyl-3,4-dihydro-2(1H)-naphthalenone
Molecular Formula:
C
14
H
18
O
2
Molecular Weight:
218.296 g/mol
Cas Number:
-
EINECS Number:
-
5-(5,5-dimethyl-1,3-dioxan-2-yl)-1H-pyrrole-2-carbaldehyde
Molecular Formula:
C
11
H
15
NO
3
Molecular Weight:
209.245 g/mol
Cas Number:
-
EINECS Number:
-
1,4,5,6,7,7a-hexahydro-2H-inden-2-one
Molecular Formula:
C
9
H
12
O
Molecular Weight:
136.194 g/mol
Cas Number:
39163-29-6
EINECS Number:
-
2-phenyl-1H-benzimidazole
Molecular Formula:
C
13
H
10
N
2
Molecular Weight:
194.236 g/mol
Cas Number:
716-79-0
EINECS Number:
211-939-2
1-acetyl-2-methoxy-2-methyl-3-methyleneindoline
Molecular Formula:
C
13
H
15
NO
2
Molecular Weight:
217.268 g/mol
Cas Number:
-
EINECS Number:
-
1-acetyl-2-(bromomethyl)-3-methyl-1H-indole
Molecular Formula:
C
12
H
12
BrNO
Molecular Weight:
266.137 g/mol
Cas Number:
-
EINECS Number:
-
1-acetyl-2,3-dimethoxy-2,3-dimethylindoline
Molecular Formula:
C
14
H
19
NO
3
Molecular Weight:
249.31 g/mol
Cas Number:
-
EINECS Number:
-
2,3-diacetyl-4-hydroxy-4-methyl-2-cyclopenten-1-one
Molecular Formula:
C
10
H
12
O
4
Molecular Weight:
196.203 g/mol
Cas Number:
-
EINECS Number:
-
2-acetyl-3,5,6-trihydroxy-5,6-dimethyl-2-cyclohexen-1-one
Molecular Formula:
C
10
H
14
O
5
Molecular Weight:
214.218 g/mol
Cas Number:
-
EINECS Number:
-
3-bromo-3-buten-2-one
Molecular Formula:
C
4
H
5
BrO
Molecular Weight:
148.987 g/mol
Cas Number:
61203-01-8
EINECS Number:
-
(3,4-dimethyl-2-oxo-3-cyclopenten-1-yl)acetic acid
Molecular Formula:
C
9
H
12
O
3
Molecular Weight:
168.192 g/mol
Cas Number:
-
EINECS Number:
-
ethyl 3-ethyl-3-fluoro-2-oxopentanoate
Molecular Formula:
C
9
H
15
FO
3
Molecular Weight:
190.215 g/mol
Cas Number:
-
EINECS Number:
-
dimethyl (2Z)-2-(1,2-dimethyl-2-propenyl)-2-butenedioate
Molecular Formula:
C
11
H
16
O
4
Molecular Weight:
212.246 g/mol
Cas Number:
-
EINECS Number:
-
Z-Dehydroalanine methyl ester
Molecular Formula:
C
12
H
13
NO
4
Molecular Weight:
235.24 g/mol
Cas Number:
21149-17-7
EINECS Number:
-
ethyl (1-chlorocyclohexyl)(methoxy)methylcarbamate
Molecular Formula:
C
11
H
20
ClNO
3
Molecular Weight:
249.737 g/mol
Cas Number:
-
EINECS Number:
-
1-chlorocyclohexanecarbaldehyde
Molecular Formula:
C
7
H
11
ClO
Molecular Weight:
146.616 g/mol
Cas Number:
-
EINECS Number:
-
3,4,5-triphenylisoxazole
Molecular Formula:
C
21
H
15
NO
Molecular Weight:
297.356 g/mol
Cas Number:
22020-72-0
EINECS Number:
-
3-phenyl-5-phenylazo-1,3,4-thiadiazol-2-one
Molecular Formula:
C
14
H
10
N
4
OS
Molecular Weight:
282.326 g/mol
Cas Number:
17883-57-7
EINECS Number:
-
2,5-hexanedione
Molecular Formula:
C
6
H
10
O
2
Molecular Weight:
114.144 g/mol
Cas Number:
110-13-4
EINECS Number:
203-738-3
N-(1,1-dimethyl-2-oxopropyl)acetamide
Molecular Formula:
C
7
H
13
NO
2
Molecular Weight:
143.186 g/mol
Cas Number:
-
EINECS Number:
-
methyl 3-bromo-5-methoxy-2-furoate
Molecular Formula:
C
7
H
7
BrO
4
Molecular Weight:
235.034 g/mol
Cas Number:
-
EINECS Number:
-
4-bromo-2-furyl methyl ether
Molecular Formula:
C
5
H
5
BrO
2
Molecular Weight:
176.997 g/mol
Cas Number:
78799-91-4
EINECS Number:
-
[2-(phenylsulfonyl)cyclopropyl]methanol
Molecular Formula:
C
10
H
12
O
3
S
Molecular Weight:
212.269 g/mol
Cas Number:
-
EINECS Number:
-
(E)-N-(5-phenyl-1,3-oxathiol-2-ylidene)benzamide
Molecular Formula:
C
16
H
11
NO
2
S
Molecular Weight:
281.335 g/mol
Cas Number:
-
EINECS Number:
-
ethyl (2E)-2-benzoylimino-5-methyl-1,3-oxathiole-4-carboxylate
Molecular Formula:
C
14
H
13
NO
4
S
Molecular Weight:
291.328 g/mol
Cas Number:
-
EINECS Number:
-
6a,7,8,10a-tetrahydro-5H-chrysen-6-one
Molecular Formula:
C
18
H
16
O
Molecular Weight:
248.324 g/mol
Cas Number:
-
EINECS Number:
-
S-ethyl 2-oxo-1-(3-oxobutyl)cyclohexanecarbothioate
Molecular Formula:
C
13
H
20
O
3
S
Molecular Weight:
256.366 g/mol
Cas Number:
-
EINECS Number:
-
7,7-dimethyl-1,2,3,4,5,6-hexahydro-naphthalene-4a-carboxylic acid
Molecular Formula:
C
13
H
20
O
2
Molecular Weight:
208.301 g/mol
Cas Number:
-
EINECS Number:
-
methyl stearate
Molecular Formula:
C
19
H
38
O
2
Molecular Weight:
298.51 g/mol
Cas Number:
112-61-8
EINECS Number:
203-990-4
1H-pyrrole-2,4-dicarbonitrile
Molecular Formula:
C
6
H
3
N
3
Molecular Weight:
117.11 g/mol
Cas Number:
74023-87-3
EINECS Number:
-
2,2-bis(ethylsulfanyl)-5-methyl-4-hexenal
Molecular Formula:
C
11
H
20
OS
2
Molecular Weight:
232.411 g/mol
Cas Number:
-
EINECS Number:
-
8a-methyl-3,4,7,8-tetrahydro-2H-naphthalene-1,6-quinone
Molecular Formula:
C
11
H
14
O
2
Molecular Weight:
178.231 g/mol
Cas Number:
20007-72-1
EINECS Number:
243-463-6
2-(1-hydroxyoctyl)cyclohexanone
Molecular Formula:
C
14
H
26
O
2
Molecular Weight:
226.359 g/mol
Cas Number:
-
EINECS Number:
-
1H-pyrrole-2-carboxamide
Molecular Formula:
C
5
H
6
N
2
O
Molecular Weight:
110.116 g/mol
Cas Number:
4551-72-8
EINECS Number:
-
2,2,2-trichloro-1-phenylethanol
Molecular Formula:
C
8
H
7
Cl
3
O
Molecular Weight:
225.501 g/mol
Cas Number:
2000-43-3
EINECS Number:
217-887-7
chloro(4-chlorophenyl)acetic acid
Molecular Formula:
C
8
H
6
Cl
2
O
2
Molecular Weight:
205.04 g/mol
Cas Number:
-
EINECS Number:
-
1-methyl-3,5-diphenyl-1H-pyrazole
Molecular Formula:
C
16
H
14
N
2
Molecular Weight:
234.301 g/mol
Cas Number:
19311-79-6
EINECS Number:
-
3,5,7-tritert-butyl-4H-1,2-diazepine
Molecular Formula:
C
17
H
30
N
2
Molecular Weight:
262.439 g/mol
Cas Number:
-
EINECS Number:
-
2,2-bis(ethylsulfanyl)propanoic acid
Molecular Formula:
C
7
H
14
O
2
S
2
Molecular Weight:
194.319 g/mol
Cas Number:
-
EINECS Number:
-
(1-methyl-2-nitropropyl)benzene
Molecular Formula:
C
10
H
13
NO
2
Molecular Weight:
179.219 g/mol
Cas Number:
-
EINECS Number:
-
3-hydroxy-1-phenyl-1-propanone
Molecular Formula:
C
9
H
10
O
2
Molecular Weight:
150.177 g/mol
Cas Number:
1321-48-8
EINECS Number:
-
ethyl pentanoate
Molecular Formula:
C
7
H
14
O
2
Molecular Weight:
130.187 g/mol
Cas Number:
539-82-2
EINECS Number:
208-726-1
2-heptanone
Molecular Formula:
C
7
H
14
O
Molecular Weight:
114.188 g/mol
Cas Number:
110-43-0
EINECS Number:
203-767-1
piperidin-2-one oxime
Molecular Formula:
C
5
H
10
N
2
O
Molecular Weight:
114.147 g/mol
Cas Number:
4515-19-9
EINECS Number:
-
4-methyl-5H-furan-2-one
Molecular Formula:
C
5
H
6
O
2
Molecular Weight:
98.101 g/mol
Cas Number:
6124-79-4
EINECS Number:
-
1-(1H-pyrrol-3-yl)ethanone
Molecular Formula:
C
6
H
7
NO
Molecular Weight:
109.128 g/mol
Cas Number:
1072-82-8
EINECS Number:
-
S-cyclohexyl cyclopropanecarbothioate
Molecular Formula:
C
10
H
16
OS
Molecular Weight:
184.302 g/mol
Cas Number:
-
EINECS Number:
-
bicyclo[3.2.1]octan-2-one
Molecular Formula:
C
8
H
12
O
Molecular Weight:
124.183 g/mol
Cas Number:
5019-82-9
EINECS Number:
225-704-7
[(1E)-4,4-bis(ethylsulfanyl)-1,3-butadienyl]benzene
Molecular Formula:
C
14
H
18
S
2
Molecular Weight:
250.429 g/mol
Cas Number:
-
EINECS Number:
-
1-cyano-5-ethyl-2-imino-4-imidazolidinone
Molecular Formula:
C
6
H
8
N
4
O
Molecular Weight:
152.156 g/mol
Cas Number:
-
EINECS Number:
-
2-methoxybutanoic acid
Molecular Formula:
C
5
H
10
O
3
Molecular Weight:
118.133 g/mol
Cas Number:
56674-69-2
EINECS Number:
-
5-ethyl-2-imino-1,3-thiazolidin-4-one
Molecular Formula:
C
5
H
8
N
2
OS
Molecular Weight:
144.197 g/mol
Cas Number:
5425-38-7
EINECS Number:
-
5-cyano-N,N,2-triethylpentanamide
Molecular Formula:
C
12
H
22
N
2
O
Molecular Weight:
210.32 g/mol
Cas Number:
-
EINECS Number:
-
3-ethyl-2-oxocyclopentanecarbonitrile
Molecular Formula:
C
8
H
11
NO
Molecular Weight:
137.181 g/mol
Cas Number:
-
EINECS Number:
-
dimethyl 2,4,7-trimethyl-4H-azepine-3,6-dicarboxylate
Molecular Formula:
C
13
H
17
NO
4
Molecular Weight:
251.282 g/mol
Cas Number:
-
EINECS Number:
-
6-methyl-6-azaspiro[3.6]decan-5-one
Molecular Formula:
C
10
H
17
NO
Molecular Weight:
167.251 g/mol
Cas Number:
71474-02-7
EINECS Number:
-
1-ethylsulfonyl-ethane
Molecular Formula:
C
4
H
10
O
2
S
Molecular Weight:
122.188 g/mol
Cas Number:
597-35-3
EINECS Number:
209-898-0
methyl (2E)-3-methyl-2-hexenoate
Molecular Formula:
C
8
H
14
O
2
Molecular Weight:
142.198 g/mol
Cas Number:
-
EINECS Number:
-
p-Nitrophenetole
Molecular Formula:
C
8
H
9
NO
3
Molecular Weight:
167.164 g/mol
Cas Number:
100-29-8
EINECS Number:
202-837-9
3-phenyl-1-propanol
Molecular Formula:
C
9
H
12
O
Molecular Weight:
136.194 g/mol
Cas Number:
122-97-4
EINECS Number:
204-587-6
2-methyl-3-phenyl-1-propanol
Molecular Formula:
C
10
H
14
O
Molecular Weight:
150.221 g/mol
Cas Number:
7384-80-7
EINECS Number:
-
1,4-dimethyl-6,8-dihydropyrazolo[3,4-b]azepin-7(1H)-one
Molecular Formula:
C
9
H
11
N
3
O
Molecular Weight:
177.206 g/mol
Cas Number:
-
EINECS Number:
-
N,3,4-trimethyl-1-phenyl-1,6-dihydropyrazolo[3,4-b]azepin-7-amine
Molecular Formula:
C
16
H
18
N
4
Molecular Weight:
266.346 g/mol
Cas Number:
-
EINECS Number:
-
1
2
3
4
5
6
7