AG00294J

2038-57-5 | Benzenepropanamine

AG00294J

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CAS Number	2038-57-5
Catalog Number	AG00294J(AGN-PC-0JKCRW)
Chemical Name	Benzenepropanamine
EC Number	218-012-1
IUPAC Name	3-phenylpropan-1-amine
InChI	InChI=1S/C9H13N/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8,10H2
InChI Key	LYUQWQRTDLVQGA-UHFFFAOYSA-N
MDL Number	MFCD00008224
Molecular Formula	C9H13N
Molecular Weight	135.2062
NSC Number	87080
SMILES	C1(=CC=CC=C1)CCCN
UNII	P8326EZ31P
Synonyms	3-phenylpropylamine, 3-Phenylpropylamine, 3-phenylpropan-1-amine, 2038-57-5, Benzenepropanamine, 1-Amino-3-phenylpropane, 3-Phenyl-1-propylamine, Hydrocinnamylamine, 3-Phenyl-n-propylamine, gamma-Phenylpropylamine, 3-Phenyl-1-propanamine, PROPYLAMINE, 3-PHENYL-, 3-phenylpropanamine, gamma-Phenyl-n-propylamine, 3-Phenyl-propylamine, phenylpropylamine, MFCD00008224, NSC 87080, UNII-P8326EZ31P, 3-Phenyl-1-aminopropane, .gamma.-Phenylpropylamine, EINECS 218-012-1, BRN 2205526, .gamma.-Phenyl-n-propylamine, CHEMBL276864, 3-Phenyl-1-propylamine, 98%, LYUQWQRTDLVQGA-UHFFFAOYSA-N, P8326EZ31P, Benzenepropanamine, hydrochloride, phenylpropyl amine, 1tnk, 1utl, 3-Phenylproylamine, 3-aminopropylbenzene, 3-phenylpropylarnine, 3-phenylpropyl-amine, (3-phenylpropyl)amine, 3-phenyl propyl amine, 3-phenyl-propyl-amine, gamma-Aminopropylbenzene, 1-phenyl-3-propylamine, ACMC-1CLGX, 3-Phenylpropylamine 98%, Benzenepropanamine (9CI), AC1L27KZ, NCIOpen2_001106, SCHEMBL52482, 4-12-00-02625 (Beilstein Handbook Reference), AC1Q54E3, DTXSID10174307, KS-000013BE, NSC87080, ZINC1561633, 0451AB, ANW-24053, BBL005325, BDBM50113826, NSC-87080, SBB028248, STK825996, AKOS000120432, AB00940, DB04410, MCULE-1006208888, PS-5335, RTR-009506, TRA0033806, AJ-27054, SC-65438, AB0062715, DB-045192, LS-125732, TR-009506, BB 0216505, FT-0616351, H2535, P0664, ST51038620, EN300-20467, 12061-EP2280001A1, 12061-EP2316828A1, J-013266, I01-10241, F2190-0400, Z1245664622, InChI=1/C9H13N/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8,10H, Benzylethylamine, N-Benzylethylamine, (3-Aminopropyl)benzol, C9H13N, C9-H13-N, CID16259, PROPYLAMINE, 3-PHENYL-, HYDROCHLORIDE, PRA,

Complexity	74.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	135.105g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	135.21g/mol
Monoisotopic Mass	135.105g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 2735

Certificate of Analysis

Lot Number