AG003JEM

148-87-8 | 3-(Ethyl(phenyl)amino)propanenitrile

AG003JEM

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CAS Number	148-87-8
Catalog Number	AG003JEM(AGN-PC-0JK8T6)
Chemical Name	3-(Ethyl(phenyl)amino)propanenitrile
EC Number	205-728-4
IUPAC Name	3-(N-ethylanilino)propanenitrile
InChI	InChI=1S/C11H14N2/c1-2-13(10-6-9-12)11-7-4-3-5-8-11/h3-5,7-8H,2,6,10H2,1H3
InChI Key	WYRNRZQRKCXPLA-UHFFFAOYSA-N
MDL Number	MFCD00019858
Molecular Formula	C11H14N2
Molecular Weight	174.2423
NSC Number	81243
SMILES	N#CCCN(CC)C1=CC=CC=C1
UNII	465EKH3OG1
Synonyms	CEPEA, N-(2-cyanoethyl)-2-phenylethylamine, 148-87-8, N-(2-Cyanoethyl)-N-ethylaniline, 3-(Ethyl(phenyl)amino)propanenitrile, Propanenitrile, 3-(ethylphenylamino)-, 3-ethylanilinopropiononitrile, 3-(Ethylphenylamino)propionitrile, 3-(N-Ethylanilino)propiononitrile, N-(Cyanoethyl)-N-ethylaniline, Propionitrile, 3-(N-ethylanilino)-, 3-(N-Ethylanilino)propionitrile, N-Ethyl-N-(2-cyanoethyl)aniline, N-Ethyl-N-cyanoethylaniline, 3-(Ethylphenylamino)propanenitrile, 3-[ethyl(phenyl)amino]propanenitrile, ANILINE, N-ETHYL-N-(2-CYANOETHYL)-, UNII-465EKH3OG1, NSC 81243, Aniline, N-(2-cyanoethyl)-N-ethyl-, N-Ethyl-N-2-kyanethylanilin, N-Ethyl-N,beta-cyanoethylaniline, EINECS 205-728-4, N-beta-Cyanoethyl-N-ethylaminobenzene, N-(2-Cyanoethyl)-2-phenylethylamine, N-Ethyl-N-2-kyanethylanilin [Czech], 3-(N-Ethyl-N-phenylamino)propionitrile, BRN 0973910, 465EKH3OG1, 3-(N-ethylanilino)propanenitrile, N-.beta.-Cyanoethyl-N-ethylaniline, N-Ethyl-N-(.beta.-cyanoethyl)aniline, N-.beta.-Cyanoethyl-N-ethylaminobenzene, W-108095, Propionitrile, 3-(N-ethylanilino)- (6CI,7CI,8CI), N-(2'-Cyanoethyl)-N-ethylaniline, NSC81243, Cyanoethylethyl aniline, AC1Q2ZLP, AC1Q2ZLQ, (2-cyanoethyl)ethylaniline, ACMC-209d1c, AC1L1S3D, AC1Q4SA9, Cambridge id 5243599, DSSTox_CID_24587, DSSTox_RID_80333, DSSTox_GSID_44587, N-cyanoethyl-N-ethyl aniline, N-Ethyl-N-cyanoethyl-aniline, KSC490G3L, SCHEMBL150182, 3-(Ethylanilino)propanenitrile, Jsp002807, CHEMBL3183872, DTXSID4044587, CTK3J0335, KS-00000ZCL, 3-(Ethylanilino)propanenitrile #, WYRNRZQRKCXPLA-UHFFFAOYSA-N, 3-(ethylphenylamino)-propanenitril, HMS1580I09, N-CYANOETHYL-N-ETHYLANILINE, 3-(Ethylphenylamino)-propanenitrile, ZINC1574332, ZX-AT008756, Tox21_301491, ANW-21166, CCG-40434, MFCD00019858, NSC-81243, SBB058902, AKOS000179712, BBV-074429, MCULE-2471173469, TRA0093619, 3-(N-ETHYLANILINO)-PROPIONITRILE, NCGC00255730-01, AC-10204, AJ-27243, AK114230, AN-43998, CAS-148-87-8, CC-31284, CC-32746, CJ-05405, CJ-24780, LS-19798, AX8013235, TC-109911, FT-0629130, ST50408158, C-05884, C11H14N2, CID8995, AR-1L2313, c0451, Propanonitrilo, 3-(etilfenilamino)-, C11-H14-N2, 4-12-00-00891 (Beilstein Handbook Reference), 79277-67-1,

Complexity	174
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	174.116g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	174.247g/mol
Monoisotopic Mass	174.116g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	27A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P264-P270-P280-P301+P312+P330-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P501
UN Code

Certificate of Analysis

Lot Number