AG003S98

94-34-8 | 3-(Methyl(phenyl)amino)propanenitrile

AG003S98

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CAS Number	94-34-8
Catalog Number	AG003S98(AGN-PC-0JL7D9)
Chemical Name	3-(Methyl(phenyl)amino)propanenitrile
EC Number	202-325-5
IUPAC Name	3-(N-methylanilino)propanenitrile
InChI	InChI=1S/C10H12N2/c1-12(9-5-8-11)10-6-3-2-4-7-10/h2-4,6-7H,5,9H2,1H3
InChI Key	IXXLKTZOCSRXEM-UHFFFAOYSA-N
MDL Number	MFCD00019856
Molecular Formula	C10H12N2
Molecular Weight	160.2157
NSC Number	91616
SMILES	N#CCCN(C)C1=CC=CC=C1
Synonyms	3-(N-methylanilino)propionitrile, 3-(N-methylanilino)propiononitrile, AI3-28714, beta-(N-methylanilio)propionitrile, N,N-cyanoethyl-methylaniline, N-methyl-N-(2-cyanoethyl)aniline, NSC 91616, 94-34-8, N-(2-Cyanoethyl)-N-methylaniline, 3-(Methyl(phenyl)amino)propanenitrile, Propanenitrile, 3-(methylphenylamino)-, N-Methyl-N-(2-cyanoethyl)aniline, N-Cyanoethyl-N-methylaniline, 3-(N-Methyl-N-phenylamino)propionitrile, 3-(N-Methylanilino)propionitrile, 3-(N-methylanilino)propanenitrile, IXXLKTZOCSRXEM-UHFFFAOYSA-N, N-.beta.-Cyanoethyl-N-methylaniline, Propionitrile, 3-(N-methylanilino)-, .beta.-(N-Methylanilino)propionitrile, 3-[methyl(phenyl)amino]propanenitrile, n-Methyl-n-cyanoethyl aniline, 3-(N-Methylanilino)propiononitrile, beta-(N-Methylanilino)propionitrile, NSC91616, EINECS 202-325-5, ACMC-209rrj, N-cyanoethyl methylaniline, AC1Q4SA8, n-methyl-n-cyanoethylaniline, NCIOpen2_000346, SCHEMBL149631, AC1L262K, DTXSID6059102, CTK8B2735, KS-00000FUZ, N-beta-Cyanoethyl-N-methylaniline, 3-(Methylanilino)propanenitrile #, .beta.-N-Methylanilinopropionitrile, 3-(methylphenylamino)propanenitrile, ZINC1699263, ANW-40253, MFCD00019856, N-CYANOETHYL-N-METHYL ANILINE, NSC-91616, AKOS000194121, DS-6285, MCULE-6871661961, VZ32909, AJ-30389, AK113496, AN-42688, CJ-28545, P941, DB-057495, TR-030601, FT-0629131, Propionitrile, 3-(N-methylanilino)- (8CI), ST24028343, ST50408100, W-100198, 3-(N-methylanilino)propiononitril, C10H12N2, CID66748, AR-1K7676, c0872, C10-H12-N2, N-(2-Cyanoethyl)-N-methylaniline, 98% - 100G 100g, 5762-35-6,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	160.1g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	160.22g/mol
Monoisotopic Mass	160.1g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	27A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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