AG000688

102-05-6 | Benzenemethanamine, N-methyl-N-(phenylmethyl)-

AG000688

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CAS Number	102-05-6
Catalog Number	AG000688(AGN-PC-0JKFZ4)
Chemical Name	Benzenemethanamine, N-methyl-N-(phenylmethyl)-
EC Number	203-001-6
IUPAC Name	N-benzyl-N-methyl-1-phenylmethanamine
InChI	InChI=1S/C15H17N/c1-16(12-14-8-4-2-5-9-14)13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3
InChI Key	WYZDCUGWXKHESN-UHFFFAOYSA-N
MDL Number	MFCD00022018
Molecular Formula	C15H17N
Molecular Weight	211.3022
NSC Number	163900
SMILES	CN(CC1=CC=CC=C1)CC2=CC=CC=C2
UNII	67VKG5DY8W
Synonyms	N-benzyl-N-methyl-1-phenylmethanamine, Dibemethine, 102-05-6, Dibenzylmethylamine, Methyldibenzylamine, Dibemethin, Revoxyl, N-Methyldibenzylamine, N-benzyl-N-methyl-1-phenylmethanamine, Methyl dibenzylamine, DBMA, Benzenemethanamine, N-methyl-N-(phenylmethyl)-, N,N-Dibenzylmethylamine, N-Methyl-N,N-dibenzylamine, UNII-67VKG5DY8W, N-methyl dibenzylamine, L 566, Dibenzylamine, N-methyl-, NSC 163900, 67VKG5DY8W, WYZDCUGWXKHESN-UHFFFAOYSA-N, NCGC00160569-01, Dibemethinum, Dibemetina, Dibemethine [INN:DCF], 5441-24-7, Dibemethinum [INN-Latin], Dibemetina [INN-Spanish], EINECS 203-001-6, dibenzyl(methyl)amine, AI3-26795, AC1L2IN7, DIBENZYL METHYL AMINE, DSSTox_CID_26238, DSSTox_RID_81465, DSSTox_GSID_46238, SCHEMBL276863, SCHEMBL6555649, Jsp000259, CHEMBL2106280, DTXSID4046238, N-benzyl-(+)-methyl-benzylamine, Dibenzylamine, N-methyl- (8CI), N-Benzyl-N-methylphenylmethanamine, KS-00000G0O, ZINC1234761, Tox21_111907, MFCD00022018, N-Benzyl-N-methylphenylmethanamine #, NSC163900, STK283922, AKOS005427167, MCULE-8128441423, NSC-163900, AK162499, AS-13057, CAS-102-05-6, BB 0259303, L-566, ST24046471, 102M056, W-108888, BRD-K01772856-003-01-7, InChI=1/C15H17N/c1-16(12-14-8-4-2-5-9-14)13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H, dibemethin-, Dibemethine [DCF:INN], C(N(C)Cc1ccccc1)c2ccccc2, C15-H17-N.Cl-H, C15H17N, N-Methyldibenzylamine hydrochloride, CID21583, C15-H17-N, NSC 21251, H166, DIBENZYLAMINE, N-METHYL-, HYDROCHLORIDE, Benzenemethanamine, N-methyl-N-(phenylmethyl)-, hydrochloride,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	211.136g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	211.308g/mol
Monoisotopic Mass	211.136g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	3.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2810

Certificate of Analysis

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