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Chemical Name
Cas Number
EINECS Number
MDL Number
Molecular Formula
InChIKey
Smiles
Journal Title
GO
Chemistry Letters - 1839 compounds - page 11
ethyl 2-oxohexanoate
Molecular Formula:
C
8
H
14
O
3
Molecular Weight:
158.197 g/mol
Cas Number:
5753-96-8
EINECS Number:
-
benzil
Molecular Formula:
C
14
H
10
O
2
Molecular Weight:
210.232 g/mol
Cas Number:
134-81-6
EINECS Number:
205-157-0
5,6-decanedione
Molecular Formula:
C
10
H
18
O
2
Molecular Weight:
170.252 g/mol
Cas Number:
5579-73-7
EINECS Number:
-
methyl dibromoacetate
Molecular Formula:
C
3
H
4
Br
2
O
2
Molecular Weight:
231.872 g/mol
Cas Number:
6482-26-4
EINECS Number:
-
1,2-difluorobenzene
Molecular Formula:
C
6
H
4
F
2
Molecular Weight:
114.095 g/mol
Cas Number:
367-11-3
EINECS Number:
206-680-7
1-chloro-2-fluorobenzene
Molecular Formula:
C
6
H
4
ClF
Molecular Weight:
130.549 g/mol
Cas Number:
348-51-6
EINECS Number:
206-476-8
1-fluoro-2-(trifluoromethyl)benzene
Molecular Formula:
C
7
H
4
F
4
Molecular Weight:
164.102 g/mol
Cas Number:
392-85-8
EINECS Number:
206-880-4
1-fluoro-2-methoxybenzene
Molecular Formula:
C
7
H
7
FO
Molecular Weight:
126.13 g/mol
Cas Number:
321-28-8
EINECS Number:
206-284-4
2-fluorophenol
Molecular Formula:
C
6
H
5
FO
Molecular Weight:
112.104 g/mol
Cas Number:
367-12-4
EINECS Number:
206-681-2
(1Z)-2,3,3-trifluoro-1-propenyl 4-methylbenzenesulfonate
Molecular Formula:
C
10
H
9
F
3
O
3
S
Molecular Weight:
266.241 g/mol
Cas Number:
-
EINECS Number:
-
(2Z)-3-(diisopropylamino)-2-fluoro-2-propenal
Molecular Formula:
C
9
H
16
FNO
Molecular Weight:
173.231 g/mol
Cas Number:
-
EINECS Number:
-
ethyl 2-[[(Z)-2-fluoro-3-oxoprop-1-enyl]amino]acetate
Molecular Formula:
C
7
H
10
FNO
3
Molecular Weight:
175.16 g/mol
Cas Number:
-
EINECS Number:
-
(2Z)-2-fluoro-3-(isopropylamino)-2-propenal
Molecular Formula:
C
6
H
10
FNO
Molecular Weight:
131.15 g/mol
Cas Number:
-
EINECS Number:
-
(2Z)-3-anilino-2-fluoro-2-propenal
Molecular Formula:
C
9
H
8
FNO
Molecular Weight:
165.167 g/mol
Cas Number:
-
EINECS Number:
-
(2Z)-2-fluoro-3-(1-pyrrolidinyl)-2-propenal
Molecular Formula:
C
7
H
10
FNO
Molecular Weight:
143.161 g/mol
Cas Number:
-
EINECS Number:
-
5-hydroxyoxacyclopentadec-3-en-2-one
Molecular Formula:
C
14
H
24
O
3
Molecular Weight:
240.343 g/mol
Cas Number:
-
EINECS Number:
-
5-hydroxyoxacyclotridec-3-en-2-one
Molecular Formula:
C
12
H
20
O
3
Molecular Weight:
212.289 g/mol
Cas Number:
-
EINECS Number:
-
2-(hydroxy-phenylmethyl)-1-phenylprop-2-en-1-one
Molecular Formula:
C
16
H
14
O
2
Molecular Weight:
238.286 g/mol
Cas Number:
-
EINECS Number:
-
7-hydroxy-6-methylideneundecan-5-one
Molecular Formula:
C
12
H
22
O
2
Molecular Weight:
198.305 g/mol
Cas Number:
-
EINECS Number:
-
methyl 2-(hydroxy-phenylmethyl)prop-2-enoate
Molecular Formula:
C
11
H
12
O
3
Molecular Weight:
192.214 g/mol
Cas Number:
18020-59-2
EINECS Number:
-
3H-isobenzofuran-1-one
Molecular Formula:
C
8
H
6
O
2
Molecular Weight:
134.134 g/mol
Cas Number:
87-41-2
EINECS Number:
201-744-0
2-tosylisoindolin-1-one
Molecular Formula:
C
15
H
13
NO
3
S
Molecular Weight:
287.339 g/mol
Cas Number:
-
EINECS Number:
-
ethyl (2E)-3-phenyl-2-propenoate
Molecular Formula:
C
11
H
12
O
2
Molecular Weight:
176.215 g/mol
Cas Number:
103-36-6
EINECS Number:
203-104-6
dimethyl (2Z)-2-methoxy-2-butenedioate
Molecular Formula:
C
7
H
10
O
5
Molecular Weight:
174.153 g/mol
Cas Number:
-
EINECS Number:
-
isobutyl 2,3-dioxobutanoate
Molecular Formula:
C
8
H
12
O
4
Molecular Weight:
172.181 g/mol
Cas Number:
-
EINECS Number:
-
2-benzyl-prop-2-enyl-benzene
Molecular Formula:
C
16
H
16
Molecular Weight:
208.303 g/mol
Cas Number:
-
EINECS Number:
-
3-butyl-5H-furan-2-one
Molecular Formula:
C
8
H
12
O
2
Molecular Weight:
140.182 g/mol
Cas Number:
-
EINECS Number:
-
3-p-anisyl-5H-furan-2-one
Molecular Formula:
C
12
H
12
O
3
Molecular Weight:
204.225 g/mol
Cas Number:
-
EINECS Number:
-
2-p-anisylcyclohex-2-en-1-one
Molecular Formula:
C
14
H
16
O
2
Molecular Weight:
216.28 g/mol
Cas Number:
-
EINECS Number:
-
3-naphthalen-2-ylsulfonyl-5,6-dihydro-4H-pyran
Molecular Formula:
C
15
H
14
O
3
S
Molecular Weight:
274.34 g/mol
Cas Number:
-
EINECS Number:
-
1-methoxy-1-(4-methoxyphenyl)acetone
Molecular Formula:
C
11
H
14
O
3
Molecular Weight:
194.23 g/mol
Cas Number:
21165-40-2
EINECS Number:
-
2-methoxy-2-(4-methoxyphenyl)propanal
Molecular Formula:
C
11
H
14
O
3
Molecular Weight:
194.23 g/mol
Cas Number:
-
EINECS Number:
-
[1]benzothieno[3,2-c]isothiazole
Molecular Formula:
C
9
H
5
NS
2
Molecular Weight:
191.277 g/mol
Cas Number:
-
EINECS Number:
-
[1]benzofuro[3,2-c]isothiazole
Molecular Formula:
C
9
H
5
NOS
Molecular Weight:
175.211 g/mol
Cas Number:
-
EINECS Number:
-
thieno[3,2-c]isothiazole
Molecular Formula:
C
5
H
3
NS
2
Molecular Weight:
141.218 g/mol
Cas Number:
-
EINECS Number:
-
2-methylene-1,5,6,10b-tetrahydropyrrolo[2,1-a]isoquinolin-3(2H)-one
Molecular Formula:
C
13
H
13
NO
Molecular Weight:
199.252 g/mol
Cas Number:
-
EINECS Number:
-
1,3-diphenyl-1-propanol
Molecular Formula:
C
15
H
16
O
Molecular Weight:
212.291 g/mol
Cas Number:
14097-24-6
EINECS Number:
-
2-methyl-4-phenyl-2-butanol
Molecular Formula:
C
11
H
16
O
Molecular Weight:
164.247 g/mol
Cas Number:
103-05-9
EINECS Number:
203-074-4
methyl 2-oxo-1-thiocyanatocyclopentane-1-carboxylate
Molecular Formula:
C
8
H
9
NO
3
S
Molecular Weight:
199.23 g/mol
Cas Number:
-
EINECS Number:
-
1-ethyl-1-formylpentyl thiocyanate
Molecular Formula:
C
9
H
15
NOS
Molecular Weight:
185.29 g/mol
Cas Number:
-
EINECS Number:
-
2-nitro-3-pentanol
Molecular Formula:
C
5
H
11
NO
3
Molecular Weight:
133.147 g/mol
Cas Number:
20575-40-0
EINECS Number:
-
1,2,4-trideoxy-4-nitropentitol
Molecular Formula:
C
5
H
11
NO
4
Molecular Weight:
149.147 g/mol
Cas Number:
-
EINECS Number:
-
N-benzyl-N'-(1-phenyl-2-propenyl)urea
Molecular Formula:
C
17
H
18
N
2
O
Molecular Weight:
266.343 g/mol
Cas Number:
-
EINECS Number:
-
N-benzyl-N'-(1,5-dimethyl-1-vinyl-4-hexenyl)urea
Molecular Formula:
C
18
H
26
N
2
O
Molecular Weight:
286.417 g/mol
Cas Number:
-
EINECS Number:
-
N-benzyl-N'-(1-phenyl-2-propenyl)carbodiimide
Molecular Formula:
C
17
H
16
N
2
Molecular Weight:
248.328 g/mol
Cas Number:
-
EINECS Number:
-
N-benzyl-N'-(1,5-dimethyl-1-vinyl-4-hexenyl)carbodiimide
Molecular Formula:
C
18
H
24
N
2
Molecular Weight:
268.402 g/mol
Cas Number:
-
EINECS Number:
-
(1,1-difluoro-3-phenylpropyl)benzene
Molecular Formula:
C
15
H
14
F
2
Molecular Weight:
232.273 g/mol
Cas Number:
-
EINECS Number:
-
1,1-difluoro-nonyl-benzene
Molecular Formula:
C
15
H
22
F
2
Molecular Weight:
240.336 g/mol
Cas Number:
-
EINECS Number:
-
(3-butoxy-1,1-difluoropropyl)benzene
Molecular Formula:
C
13
H
18
F
2
O
Molecular Weight:
228.282 g/mol
Cas Number:
-
EINECS Number:
-
(4Z,7E)-6-hydroxy-5-methyl-4,7-nonadien-3-one
Molecular Formula:
C
10
H
16
O
2
Molecular Weight:
168.236 g/mol
Cas Number:
-
EINECS Number:
-
5-ethyl-3-methyl-2-[(1E)-1-propenyl]furan
Molecular Formula:
C
10
H
14
O
Molecular Weight:
150.221 g/mol
Cas Number:
-
EINECS Number:
-
phenyl(3,4,6-trimethyl-3-cyclohexen-1-yl)methanone
Molecular Formula:
C
16
H
20
O
Molecular Weight:
228.334 g/mol
Cas Number:
-
EINECS Number:
-
5-butyl-1,2,4-benzenetricarbonitrile
Molecular Formula:
C
13
H
11
N
3
Molecular Weight:
209.251 g/mol
Cas Number:
-
EINECS Number:
-
2-hydroxy-1,2-diphenyl-1-hexanone
Molecular Formula:
C
18
H
20
O
2
Molecular Weight:
268.356 g/mol
Cas Number:
-
EINECS Number:
-
benzyl 3-phenylpropanoate
Molecular Formula:
C
16
H
16
O
2
Molecular Weight:
240.302 g/mol
Cas Number:
-
EINECS Number:
-
ethyl 4-(1-hydroxycyclohexyl)-3-oxobutanoate
Molecular Formula:
C
12
H
20
O
4
Molecular Weight:
228.288 g/mol
Cas Number:
-
EINECS Number:
-
tert-butyl 3,5-dioxo-5-tetrahydro-2-furanylpentanoate
Molecular Formula:
C
13
H
20
O
5
Molecular Weight:
256.299 g/mol
Cas Number:
-
EINECS Number:
-
2-(2-sulfanylidene1,3-thiazolidine-3-carbonyl)cyclopentan-1-one
Molecular Formula:
C
9
H
11
NO
2
S
2
Molecular Weight:
229.324 g/mol
Cas Number:
-
EINECS Number:
-
3-nitro-1,2-dihydronaphthalene
Molecular Formula:
C
10
H
9
NO
2
Molecular Weight:
175.187 g/mol
Cas Number:
-
EINECS Number:
-
4-tert-butylcyclohexanone
Molecular Formula:
C
10
H
18
O
Molecular Weight:
154.252 g/mol
Cas Number:
98-53-3
EINECS Number:
202-678-5
1-phenyl-1-propanone
Molecular Formula:
C
9
H
10
O
Molecular Weight:
134.178 g/mol
Cas Number:
93-55-0
EINECS Number:
202-257-6
6-nitro-9-phenyl-4-nonanone
Molecular Formula:
C
15
H
21
NO
3
Molecular Weight:
263.337 g/mol
Cas Number:
-
EINECS Number:
-
3-nitro-1,3-diphenyl-1-propanone
Molecular Formula:
C
15
H
13
NO
3
Molecular Weight:
255.273 g/mol
Cas Number:
-
EINECS Number:
-
3-methyl-3-nitro-1-phenyl-1-butanone
Molecular Formula:
C
11
H
13
NO
3
Molecular Weight:
207.229 g/mol
Cas Number:
-
EINECS Number:
-
5-nitro-7-oxo-7-phenylheptyl acetate
Molecular Formula:
C
15
H
19
NO
5
Molecular Weight:
293.32 g/mol
Cas Number:
-
EINECS Number:
-
chalcone
Molecular Formula:
C
15
H
12
O
Molecular Weight:
208.26 g/mol
Cas Number:
94-41-7
EINECS Number:
210-383-8
(5E)-9-phenyl-5-nonen-4-one
Molecular Formula:
C
15
H
20
O
Molecular Weight:
216.323 g/mol
Cas Number:
-
EINECS Number:
-
3-methyl-1-phenyl-2-buten-1-one
Molecular Formula:
C
11
H
12
O
Molecular Weight:
160.216 g/mol
Cas Number:
5650-07-7
EINECS Number:
-
(5E)-7-oxo-7-phenyl-5-heptenyl acetate
Molecular Formula:
C
15
H
18
O
3
Molecular Weight:
246.306 g/mol
Cas Number:
-
EINECS Number:
-
diethyl (1E)-3-hydroxy-1-heptenylphosphonate
Molecular Formula:
C
11
H
23
O
4
P
Molecular Weight:
250.275 g/mol
Cas Number:
-
EINECS Number:
-
6-phenyl-5-hexynyl acetate
Molecular Formula:
C
14
H
16
O
2
Molecular Weight:
216.28 g/mol
Cas Number:
-
EINECS Number:
-
5-phenyl-pent-1-ynyl-benzene
Molecular Formula:
C
17
H
16
Molecular Weight:
220.314 g/mol
Cas Number:
-
EINECS Number:
-
oct-4-ynoxy-methyl-benzene
Molecular Formula:
C
15
H
20
O
Molecular Weight:
216.323 g/mol
Cas Number:
-
EINECS Number:
-
[2-(4-methoxyphenyl)cyclopropyl]methanol
Molecular Formula:
C
11
H
14
O
2
Molecular Weight:
178.231 g/mol
Cas Number:
-
EINECS Number:
-
[2-(4-chlorophenyl)cyclopropyl]methanol
Molecular Formula:
C
10
H
11
ClO
Molecular Weight:
182.649 g/mol
Cas Number:
-
EINECS Number:
-
(2-benzylcyclopropyl)methanol
Molecular Formula:
C
11
H
14
O
Molecular Weight:
162.232 g/mol
Cas Number:
-
EINECS Number:
-
2-allyl-1,2,3,4-tetrahydroisoquinoline
Molecular Formula:
C
12
H
15
N
Molecular Weight:
173.258 g/mol
Cas Number:
-
EINECS Number:
-
N-allyl-N-phenylamine
Molecular Formula:
C
9
H
11
N
Molecular Weight:
133.193 g/mol
Cas Number:
589-09-3
EINECS Number:
209-633-9
cinnamyl-diisopropyl-amine
Molecular Formula:
C
15
H
23
N
Molecular Weight:
217.354 g/mol
Cas Number:
-
EINECS Number:
-
N,N-dibenzyl-2-methyl-2-propen-1-amine
Molecular Formula:
C
18
H
21
N
Molecular Weight:
251.371 g/mol
Cas Number:
-
EINECS Number:
-
(2E)-N,N-dibenzyl-2-buten-1-amine
Molecular Formula:
C
18
H
21
N
Molecular Weight:
251.371 g/mol
Cas Number:
-
EINECS Number:
-
3-allyl-5,6-diphenyl-2-pyrazinecarbonitrile
Molecular Formula:
C
20
H
15
N
3
Molecular Weight:
297.359 g/mol
Cas Number:
-
EINECS Number:
-
2-pentyl-1-nonen-3-yne
Molecular Formula:
C
14
H
24
Molecular Weight:
192.345 g/mol
Cas Number:
-
EINECS Number:
-
(1-methylene-3-phenyl-2-propynyl)benzene
Molecular Formula:
C
16
H
12
Molecular Weight:
204.271 g/mol
Cas Number:
-
EINECS Number:
-
ethyl 2,2-difluoro-4-oxobutanoate
Molecular Formula:
C
6
H
8
F
2
O
3
Molecular Weight:
166.125 g/mol
Cas Number:
-
EINECS Number:
-
ethyl 1-cyclopenten-1-yl(difluoro)acetate
Molecular Formula:
C
9
H
12
F
2
O
2
Molecular Weight:
190.19 g/mol
Cas Number:
-
EINECS Number:
-
ethyl (3E)-2,2-difluoro-3-decenoate
Molecular Formula:
C
12
H
20
F
2
O
2
Molecular Weight:
234.286 g/mol
Cas Number:
-
EINECS Number:
-
1,2-difluoro-3-methoxybenzene
Molecular Formula:
C
7
H
6
F
2
O
Molecular Weight:
144.121 g/mol
Cas Number:
134364-69-5
EINECS Number:
-
1-phenyl-1,2-ethanediamine
Molecular Formula:
C
8
H
12
N
2
Molecular Weight:
136.197 g/mol
Cas Number:
5700-56-1
EINECS Number:
-
3-methyl-1,3-nonanediol
Molecular Formula:
C
10
H
22
O
2
Molecular Weight:
174.283 g/mol
Cas Number:
-
EINECS Number:
-
4-phenylcyclohexanol
Molecular Formula:
C
12
H
16
O
Molecular Weight:
176.258 g/mol
Cas Number:
5437-46-7
EINECS Number:
-
N-benzyl-1-phenylmethanamine
Molecular Formula:
C
14
H
15
N
Molecular Weight:
197.28 g/mol
Cas Number:
103-49-1
EINECS Number:
203-117-7
furan-2-yl-methyl-phenyl-amine
Molecular Formula:
C
11
H
11
NO
Molecular Weight:
173.214 g/mol
Cas Number:
4439-56-9
EINECS Number:
-
N-benzyl-3-phenyl-1-propanamine
Molecular Formula:
C
16
H
19
N
Molecular Weight:
225.334 g/mol
Cas Number:
-
EINECS Number:
-
benzyl-cinnamyl-amine
Molecular Formula:
C
16
H
17
N
Molecular Weight:
223.318 g/mol
Cas Number:
40032-55-1
EINECS Number:
-
2,7-dimethyloctane
Molecular Formula:
C
10
H
22
Molecular Weight:
142.285 g/mol
Cas Number:
1072-16-8
EINECS Number:
-
Bicyclohexyl
Molecular Formula:
C
12
H
22
Molecular Weight:
166.307 g/mol
Cas Number:
92-51-3
EINECS Number:
202-161-4
[(2E)-2-butenylsulfanyl]benzene
Molecular Formula:
C
10
H
12
S
Molecular Weight:
164.271 g/mol
Cas Number:
36195-56-9
EINECS Number:
-
1-cyclohex-2-enylsulfanyl-benzene
Molecular Formula:
C
12
H
14
S
Molecular Weight:
190.309 g/mol
Cas Number:
-
EINECS Number:
-
[(E)-2-[(E)-but-2-enyl]sulfanyl-vinyl]-benzene
Molecular Formula:
C
12
H
14
S
Molecular Weight:
190.309 g/mol
Cas Number:
-
EINECS Number:
-
1
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