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EINECS Number
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Smiles
Journal Title
GO
Journal of the American Chemical Society - 6338 compounds - page 49
3-diethylamino-propyl-methyl-(4-nitroso-phenyl)-amine
Molecular Formula:
C
14
H
23
N
3
O
Molecular Weight:
249.356 g/mol
Cas Number:
-
EINECS Number:
-
N,N-diethyl-N'-methylpropane-1,3-diamine
Molecular Formula:
C
8
H
20
N
2
Molecular Weight:
144.26 g/mol
Cas Number:
5459-95-0
EINECS Number:
-
4-chloro-2-phenylquinazoline
Molecular Formula:
C
14
H
9
ClN
2
Molecular Weight:
240.692 g/mol
Cas Number:
6484-25-9
EINECS Number:
229-346-2
7-chloro-4-quinazolinol
Molecular Formula:
C
8
H
5
ClN
2
O
Molecular Weight:
180.593 g/mol
Cas Number:
31374-18-2
EINECS Number:
-
2-(4-quinazolinylamino)ethanol
Molecular Formula:
C
10
H
11
N
3
O
Molecular Weight:
189.217 g/mol
Cas Number:
5423-59-6
EINECS Number:
-
7-chloro-2H-phthalazin-1-one
Molecular Formula:
C
8
H
5
ClN
2
O
Molecular Weight:
180.593 g/mol
Cas Number:
-
EINECS Number:
-
7-chloro-2-quinolinol
Molecular Formula:
C
9
H
6
ClNO
Molecular Weight:
179.605 g/mol
Cas Number:
22614-72-8
EINECS Number:
-
1-methyl-5-nitroquinolin-2-one
Molecular Formula:
C
10
H
8
N
2
O
3
Molecular Weight:
204.185 g/mol
Cas Number:
-
EINECS Number:
-
2-(1-acetyl-2-piperidinyl)-1-methylethylamine
Molecular Formula:
C
10
H
20
N
2
O
Molecular Weight:
184.282 g/mol
Cas Number:
-
EINECS Number:
-
7-chloro-4-quinolinesulfonic acid
Molecular Formula:
C
9
H
6
ClNO
3
S
Molecular Weight:
243.67 g/mol
Cas Number:
-
EINECS Number:
-
4-methyl-6-quinolinol
Molecular Formula:
C
10
H
9
NO
Molecular Weight:
159.188 g/mol
Cas Number:
5429-01-6
EINECS Number:
-
1-isopropyl-2-methoxy-4-methyl-5-vinylbenzene
Molecular Formula:
C
13
H
18
O
Molecular Weight:
190.285 g/mol
Cas Number:
-
EINECS Number:
-
3-ethyl-2-methyl-3-pentanol
Molecular Formula:
C
8
H
18
O
Molecular Weight:
130.23 g/mol
Cas Number:
597-05-7
EINECS Number:
-
2-thienylmethanamine
Molecular Formula:
C
5
H
7
NS
Molecular Weight:
113.183 g/mol
Cas Number:
27757-85-3
EINECS Number:
248-639-6
m-tolylsulfanyl-methanethioic acid O-ethyl ester
Molecular Formula:
C
10
H
12
OS
2
Molecular Weight:
212.337 g/mol
Cas Number:
-
EINECS Number:
-
3-methylbenzenethiol
Molecular Formula:
C
7
H
8
S
Molecular Weight:
124.207 g/mol
Cas Number:
108-40-7
EINECS Number:
203-578-4
4-benzylsulfanyl-8-nitroquinoline
Molecular Formula:
C
16
H
12
N
2
O
2
S
Molecular Weight:
296.35 g/mol
Cas Number:
-
EINECS Number:
-
N',N'-diethyl-N-(6-methoxy-5-methylquinolin-8-yl)ethane-1,2-diamine
Molecular Formula:
C
17
H
25
N
3
O
Molecular Weight:
287.405 g/mol
Cas Number:
5431-54-9
EINECS Number:
-
N,N-diethyl-N'-quinolin-7-ylpentane-1,4-diamine
Molecular Formula:
C
18
H
27
N
3
Molecular Weight:
285.433 g/mol
Cas Number:
-
EINECS Number:
-
3-amino-propyl-(6-methoxy-quinolin-8-yl)-amine
Molecular Formula:
C
13
H
17
N
3
O
Molecular Weight:
231.298 g/mol
Cas Number:
6284-17-9
EINECS Number:
-
6-methoxy-8-nitroquinoline
Molecular Formula:
C
10
H
8
N
2
O
3
Molecular Weight:
204.185 g/mol
Cas Number:
85-81-4
EINECS Number:
201-633-7
N-(5-amino-6-methylsulfanylquinolin-8-yl)acetamide
Molecular Formula:
C
12
H
13
N
3
OS
Molecular Weight:
247.321 g/mol
Cas Number:
134992-40-8
EINECS Number:
-
N-(6-chloro-5-nitro-8-quinolinyl)acetamide
Molecular Formula:
C
11
H
8
ClN
3
O
3
Molecular Weight:
265.656 g/mol
Cas Number:
-
EINECS Number:
-
6-methoxyquinoline
Molecular Formula:
C
10
H
9
NO
Molecular Weight:
159.188 g/mol
Cas Number:
5263-87-6
EINECS Number:
226-077-2
3,6-dichloro-10H-acridin-9-one
Molecular Formula:
C
13
H
7
Cl
2
NO
Molecular Weight:
264.11 g/mol
Cas Number:
-
EINECS Number:
-
1,5-pentanediol
Molecular Formula:
C
5
H
12
O
2
Molecular Weight:
104.149 g/mol
Cas Number:
111-29-5
EINECS Number:
203-854-4
4-(4-methoxyphenyl)cyclohexanecarboxylic acid
Molecular Formula:
C
14
H
18
O
3
Molecular Weight:
234.295 g/mol
Cas Number:
-
EINECS Number:
-
4-(4-methoxyphenyl)-benzoic acid
Molecular Formula:
C
14
H
12
O
3
Molecular Weight:
228.247 g/mol
Cas Number:
725-14-4
EINECS Number:
-
1,1,2-trichloro-3,3-dimethylbutane
Molecular Formula:
C
6
H
11
Cl
3
Molecular Weight:
189.511 g/mol
Cas Number:
-
EINECS Number:
-
4-acetylphenyl acetate
Molecular Formula:
C
10
H
10
O
3
Molecular Weight:
178.188 g/mol
Cas Number:
13031-43-1
EINECS Number:
235-894-3
1-(chloromethyl)-4-ethylbenzene
Molecular Formula:
C
9
H
11
Cl
Molecular Weight:
154.639 g/mol
Cas Number:
1467-05-6
EINECS Number:
-
2-methyl-3,4-dihydro-2H-phenanthren-1-one
Molecular Formula:
C
15
H
14
O
Molecular Weight:
210.276 g/mol
Cas Number:
3580-60-7
EINECS Number:
-
4,5-dimethyl-2-phenyl-2H-1,2,3-triazole
Molecular Formula:
C
10
H
11
N
3
Molecular Weight:
173.218 g/mol
Cas Number:
58737-90-9
EINECS Number:
-
1-ethyl 3-methyl 2-butylmalonate
Molecular Formula:
C
10
H
18
O
4
Molecular Weight:
202.251 g/mol
Cas Number:
-
EINECS Number:
-
1-ethyl 3-methyl 2-isobutylmalonate
Molecular Formula:
C
10
H
18
O
4
Molecular Weight:
202.251 g/mol
Cas Number:
-
EINECS Number:
-
1-ethyl 3-methyl 2-sec-butylmalonate
Molecular Formula:
C
10
H
18
O
4
Molecular Weight:
202.251 g/mol
Cas Number:
-
EINECS Number:
-
1-[3-(4-chlorophenyl)-4-quinolinyl]ethanone
Molecular Formula:
C
17
H
12
ClNO
Molecular Weight:
281.741 g/mol
Cas Number:
-
EINECS Number:
-
2-phenyl-4-quinolinecarboxylic acid
Molecular Formula:
C
16
H
11
NO
2
Molecular Weight:
249.269 g/mol
Cas Number:
132-60-5
EINECS Number:
205-067-1
2-quinolinecarboxylic acid
Molecular Formula:
C
10
H
7
NO
2
Molecular Weight:
173.171 g/mol
Cas Number:
93-10-7
EINECS Number:
202-218-3
6-methoxy-8-quinolinecarboxylic acid
Molecular Formula:
C
11
H
9
NO
3
Molecular Weight:
203.197 g/mol
Cas Number:
-
EINECS Number:
-
2-(4-chlorophenyl)-7-methoxy-4-quinazolinol
Molecular Formula:
C
15
H
11
ClN
2
O
2
Molecular Weight:
286.717 g/mol
Cas Number:
-
EINECS Number:
-
N-cyclopentyl-N-methylethane-1,2-diamine
Molecular Formula:
C
8
H
18
N
2
Molecular Weight:
142.244 g/mol
Cas Number:
-
EINECS Number:
-
3-(butyl-methylamino)propanenitrile
Molecular Formula:
C
8
H
16
N
2
Molecular Weight:
140.229 g/mol
Cas Number:
-
EINECS Number:
-
2-(cyclopentyl-methylamino)acetonitrile
Molecular Formula:
C
8
H
14
N
2
Molecular Weight:
138.213 g/mol
Cas Number:
-
EINECS Number:
-
2-bromo-1-(4-hydroxy-3-methoxyphenyl)ethanone
Molecular Formula:
C
9
H
9
BrO
3
Molecular Weight:
245.073 g/mol
Cas Number:
-
EINECS Number:
-
1,1,1-trimethoxypentane
Molecular Formula:
C
8
H
18
O
3
Molecular Weight:
162.229 g/mol
Cas Number:
13820-09-2
EINECS Number:
237-496-5
methyl 2-benzylpentanoate
Molecular Formula:
C
13
H
18
O
2
Molecular Weight:
206.285 g/mol
Cas Number:
-
EINECS Number:
-
Pyrilamine
Molecular Formula:
C
17
H
23
N
3
O
Molecular Weight:
285.389 g/mol
Cas Number:
91-84-9
EINECS Number:
-
2-amino-ethyl-dibutyl-amine
Molecular Formula:
C
10
H
24
N
2
Molecular Weight:
172.314 g/mol
Cas Number:
3529-09-7
EINECS Number:
222-558-6
1,2,3,4-tetrahydro-9-phenanthrenecarbaldehyde
Molecular Formula:
C
15
H
14
O
Molecular Weight:
210.276 g/mol
Cas Number:
-
EINECS Number:
-
cyanic bromide
Molecular Formula:
CBrN
Molecular Weight:
105.922 g/mol
Cas Number:
506-68-3
EINECS Number:
208-051-2
2-phenylsuccinonitrile
Molecular Formula:
C
10
H
8
N
2
Molecular Weight:
156.187 g/mol
Cas Number:
13706-68-8
EINECS Number:
-
1,2,3,4,5,6,7,8-octahydroanthracene
Molecular Formula:
C
14
H
18
Molecular Weight:
186.297 g/mol
Cas Number:
1079-71-6
EINECS Number:
-
4-(2-chloroacetyl)-8-quinolinyl acetate
Molecular Formula:
C
13
H
10
ClNO
3
Molecular Weight:
263.68 g/mol
Cas Number:
-
EINECS Number:
-
(2E,4Z)-2,4-dibenzylidenedihydro-3(2H)-thiophenone
Molecular Formula:
C
18
H
14
OS
Molecular Weight:
278.375 g/mol
Cas Number:
-
EINECS Number:
-
tetrahydro-thiophen-3-one
Molecular Formula:
C
4
H
6
OS
Molecular Weight:
102.157 g/mol
Cas Number:
1003-04-9
EINECS Number:
213-698-9
methyl (2Z)-3-amino-2-pentenoate
Molecular Formula:
C
6
H
11
NO
2
Molecular Weight:
129.159 g/mol
Cas Number:
-
EINECS Number:
-
2,5-diethyl-3,4-furandicarboxylic acid
Molecular Formula:
C
10
H
12
O
5
Molecular Weight:
212.202 g/mol
Cas Number:
-
EINECS Number:
-
dimethyl 2,3-dipropionylsuccinate
Molecular Formula:
C
12
H
18
O
6
Molecular Weight:
258.271 g/mol
Cas Number:
-
EINECS Number:
-
methyl 3-(2-methoxy-2-oxoethyl)sulfanylpropanoate
Molecular Formula:
C
7
H
12
O
4
S
Molecular Weight:
192.236 g/mol
Cas Number:
7400-45-5
EINECS Number:
231-002-1
methyl 3-oxotetrahydro-2-thiophenecarboxylate
Molecular Formula:
C
6
H
8
O
3
S
Molecular Weight:
160.194 g/mol
Cas Number:
2689-69-2
EINECS Number:
220-257-4
methyl (4Z)-4-benzylidene-3-oxotetrahydro-2-thiophenecarboxylate
Molecular Formula:
C
13
H
12
O
3
S
Molecular Weight:
248.302 g/mol
Cas Number:
-
EINECS Number:
-
dinitro-methyl-benzene
Molecular Formula:
C
7
H
6
N
2
O
4
Molecular Weight:
182.136 g/mol
Cas Number:
611-38-1
EINECS Number:
-
2,3-dimethylbutanal
Molecular Formula:
C
6
H
12
O
Molecular Weight:
100.161 g/mol
Cas Number:
2109-98-0
EINECS Number:
-
5-bromo-6-(ethoxymethyl)-2-methyl-4-pyrimidinol
Molecular Formula:
C
8
H
11
BrN
2
O
2
Molecular Weight:
247.092 g/mol
Cas Number:
-
EINECS Number:
-
4-(4-cyclohexyloxy-cyclohexyl)-butyric acid
Molecular Formula:
C
16
H
28
O
3
Molecular Weight:
268.397 g/mol
Cas Number:
-
EINECS Number:
-
4-(4-phenoxyphenyl)butanoic acid
Molecular Formula:
C
16
H
16
O
3
Molecular Weight:
256.301 g/mol
Cas Number:
6958-94-7
EINECS Number:
-
4-oxo-4-(4-phenoxyphenyl)butanoic acid
Molecular Formula:
C
16
H
14
O
4
Molecular Weight:
270.285 g/mol
Cas Number:
36330-86-6
EINECS Number:
-
3-fluoro-2-hydroxybenzaldehyde
Molecular Formula:
C
7
H
5
FO
2
Molecular Weight:
140.114 g/mol
Cas Number:
394-50-3
EINECS Number:
-
4-isothiocyanatobenzenesulfonamide
Molecular Formula:
C
7
H
6
N
2
O
2
S
2
Molecular Weight:
214.269 g/mol
Cas Number:
51908-29-3
EINECS Number:
-
(E)-2-(2,4-dimethylphenyl)ethenylphosphonic acid
Molecular Formula:
C
10
H
13
O
3
P
Molecular Weight:
212.185 g/mol
Cas Number:
-
EINECS Number:
-
ethyl 3-bromo-4-hydroxy-2-quinolinecarboxylate
Molecular Formula:
C
12
H
10
BrNO
3
Molecular Weight:
296.12 g/mol
Cas Number:
-
EINECS Number:
-
dibenzo[a,e]cyclooctene-5,12-dicarbonitrile
Molecular Formula:
C
18
H
10
N
2
Molecular Weight:
254.291 g/mol
Cas Number:
-
EINECS Number:
-
4,7-dichloro-6-quinolinesulfonyl chloride
Molecular Formula:
C
9
H
4
Cl
3
NO
2
S
Molecular Weight:
296.56 g/mol
Cas Number:
-
EINECS Number:
-
phenyl-thiophen-2-ylmethanone
Molecular Formula:
C
11
H
8
OS
Molecular Weight:
188.25 g/mol
Cas Number:
135-00-2
EINECS Number:
205-169-6
6-methoxy-N-phenylquinoline-5,8-diimine
Molecular Formula:
C
16
H
13
N
3
O
Molecular Weight:
263.299 g/mol
Cas Number:
-
EINECS Number:
-
6-methoxy-N-phenylquinoline-5,8-diamine
Molecular Formula:
C
16
H
15
N
3
O
Molecular Weight:
265.315 g/mol
Cas Number:
-
EINECS Number:
-
7-chloro-2,4-quinolinedicarboxylic acid
Molecular Formula:
C
11
H
6
ClNO
4
Molecular Weight:
251.626 g/mol
Cas Number:
-
EINECS Number:
-
7-quinolinecarboxylic acid
Molecular Formula:
C
10
H
7
NO
2
Molecular Weight:
173.171 g/mol
Cas Number:
1078-30-4
EINECS Number:
-
butyl 4-hydroxy-3-methoxybenzenecarboximidoate
Molecular Formula:
C
12
H
17
NO
3
Molecular Weight:
223.272 g/mol
Cas Number:
-
EINECS Number:
-
4-hydroxy-3-methoxybenzamide
Molecular Formula:
C
8
H
9
NO
3
Molecular Weight:
167.164 g/mol
Cas Number:
-
EINECS Number:
-
3-(3-vinyl-4-piperidinyl)propanoic acid
Molecular Formula:
C
10
H
17
NO
2
Molecular Weight:
183.251 g/mol
Cas Number:
-
EINECS Number:
-
ethyl 3-(3-vinyl-4-piperidinyl)propanoate
Molecular Formula:
C
12
H
21
NO
2
Molecular Weight:
211.304 g/mol
Cas Number:
-
EINECS Number:
-
8-(1-piperidinylmethyl)-7-quinolinol
Molecular Formula:
C
15
H
18
N
2
O
Molecular Weight:
242.321 g/mol
Cas Number:
-
EINECS Number:
-
8-methyl-7-quinolinol
Molecular Formula:
C
10
H
9
NO
Molecular Weight:
159.188 g/mol
Cas Number:
-
EINECS Number:
-
7-isoquinolinol
Molecular Formula:
C
9
H
7
NO
Molecular Weight:
145.161 g/mol
Cas Number:
7651-83-4
EINECS Number:
-
2,5-dihydroxybenzo-1,4-quinone
Molecular Formula:
C
6
H
4
O
4
Molecular Weight:
140.095 g/mol
Cas Number:
615-94-1
EINECS Number:
210-454-3
ethyl 3-(3-chloroanilino)propanoate
Molecular Formula:
C
11
H
14
ClNO
2
Molecular Weight:
227.69 g/mol
Cas Number:
-
EINECS Number:
-
3-piperidin-1-yl-propionic acid ethyl ester
Molecular Formula:
C
10
H
19
NO
2
Molecular Weight:
185.266 g/mol
Cas Number:
19653-33-9
EINECS Number:
243-205-2
2-benzoyl-1,2-dihydro-1-isoquinolinecarbonitrile
Molecular Formula:
C
17
H
12
N
2
O
Molecular Weight:
260.295 g/mol
Cas Number:
844-25-7
EINECS Number:
-
3-chloro-N,N-diethylpropan-1-amine
Molecular Formula:
C
7
H
16
ClN
Molecular Weight:
149.663 g/mol
Cas Number:
104-77-8
EINECS Number:
-
dibenzothiophen-3-yl-amine
Molecular Formula:
C
12
H
9
NS
Molecular Weight:
199.276 g/mol
Cas Number:
-
EINECS Number:
-
2-amino-ethyl-octyl-amine
Molecular Formula:
C
10
H
24
N
2
Molecular Weight:
172.314 g/mol
Cas Number:
40510-21-2
EINECS Number:
-
N,N-dimethyl-4-quinolin-2-ylaniline
Molecular Formula:
C
17
H
16
N
2
Molecular Weight:
248.328 g/mol
Cas Number:
16032-41-0
EINECS Number:
-
ethyl 5-methyl-2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate
Molecular Formula:
C
7
H
10
N
2
O
3
Molecular Weight:
170.168 g/mol
Cas Number:
82831-19-4
EINECS Number:
-
ethyl 6-(5-methyl-2-oxo-2,3-dihydro-1H-imidazol-4-yl)-6-oxohexanoate
Molecular Formula:
C
12
H
18
N
2
O
4
Molecular Weight:
254.286 g/mol
Cas Number:
-
EINECS Number:
-
5-ethyl-6-methyl-2-thioxo-1H-pyrimidin-4-one
Molecular Formula:
C
7
H
10
N
2
OS
Molecular Weight:
170.235 g/mol
Cas Number:
39083-15-3
EINECS Number:
-
ethyl 6-oxoheptanoate
Molecular Formula:
C
9
H
16
O
3
Molecular Weight:
172.224 g/mol
Cas Number:
-
EINECS Number:
-
4-ethyl-4-formylheptanenitrile
Molecular Formula:
C
10
H
17
NO
Molecular Weight:
167.251 g/mol
Cas Number:
-
EINECS Number:
-
4-ethyl-4-formylheptanoic acid
Molecular Formula:
C
10
H
18
O
3
Molecular Weight:
186.251 g/mol
Cas Number:
-
EINECS Number:
-
1
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