AG005N00

77-38-3 | {2-[1-(4-chlorophenyl)-1-phenylethoxy]ethyl}dimethylamine

AG005N00

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CAS Number	77-38-3
Catalog Number	AG005N00(AGN-PC-0510P2)
Chemical Name	{2-[1-(4-chlorophenyl)-1-phenylethoxy]ethyl}dimethylamine
IUPAC Name	2-[1-(4-chlorophenyl)-1-phenylethoxy]-N,N-dimethylethanamine
InChI	InChI=1S/C18H22ClNO/c1-18(21-14-13-20(2)3,15-7-5-4-6-8-15)16-9-11-17(19)12-10-16/h4-12H,13-14H2,1-3H3
InChI Key	KKHPNPMTPORSQE-UHFFFAOYSA-N
MDL Number	MFCD00866588
Molecular Formula	C18H22ClNO
Molecular Weight	303.8264
SMILES	CN(C)CCOC(C)(C1=CC=CC=C1)C1=CC=C(Cl)C=C1
Synonyms	chlorphenoxamine, chlorphenoxamine hydrochloride, Systral, Chlorphenoxamine, 77-38-3, Contristamine, 2-(1-(4-Chlorophenyl)-1-phenylethoxy)-N,N-dimethylethanamine, Clorfenossamina [DCIT], Chlorphenoxamine [INN:BAN], Clorfenoxamina [INN-Spanish], Chlorphenoxaminum [INN-Latin], BRN 2057618, p-Chlor-alpha-methyl-diphenhydramin [German], 2-(1-(p-Chlorophenyl)-1-phenylethoxy)-N,N-dimethylethylamine, 2-[1-(4-Chlorophenyl)-1-phenylethoxy]-N,N-dimethylethanamine, p-Chlor-.alpha.-methyl-diphenhydramin, AK-57052, beta-Dimethylamino-aethyl-(p-chlor-alpha-methylbenzhydryl)-aether [German], Clorfenossamina, Clorfenoxamina, Ethylamine, 2-[1-(p-chlorophenyl)-1-phenylethoxy]-N,N-dimethyl-, Chlorphenoxaminum, Ethanamine, 2-(1-(4-chlorophenyl)-1-phenylethoxy)-N,N-dimethyl-, Ethanamine, 2-[1-(4-chlorophenyl)-1-phenylethoxy]-N,N-dimethyl-, ETHYLAMINE, 2-(1-(p-CHLOROPHENYL)-1-PHENYLETHOXY)-N,N-DIMETHYL-, p-Chlor-alpha-methyl-diphenhydramin, Chlorphenoxamine (INN), EC 616-456-4, AC1L1MM0, SCHEMBL29208, 4-06-00-04717 (Beilstein Handbook Reference), CHEMBL2110774, DTXSID5022805, CTK8C5169, KS-00000FWU, CHEBI:135288, KKHPNPMTPORSQE-UHFFFAOYSA-N, beta-Dimethylamino-aethyl-(p-chlor-alpha-methylbenzhydryl)-aether, HY-B1607, ANW-74407, MFCD00866588, AKOS015894659, API0010990, CS-5310, DB09007, NCGC00484055-01, CC-25727, LS-68026, AX8120985, TR-037773, FT-0682434, X5916, D07198, C-23736, SR-01000944418, I05-1381, SR-01000944418-1, {2-[1-(4-Chlorophenyl)-1-phenylethoxy]ethyl}dimethylamine, (S)-2-(1-(4-chlorophenyl)-1-phenylethoxy)-N,N-dimethylethanamine, 2-[1-(4-chlorophenyl)-1-phenyl-ethoxy]-N,N-dimethyl-ethanamine, 2-{[1-(4-chlorophenyl)-1-phenylethyl]oxy}-N,N-dimethylethanamine, .beta.-Dimethylamino-aethyl-(p-chlor-.alpha.-methylbenzhydryl)-aether, Ethanamine, 2-(1-(4-chlorophenyl)-1-phenylethoxy)-N,N-dimethyl- (9CI), Systral, Chlorphenoxamide, Antihistamine compound, C18H22ClNO, UNII-3UVD77BP8R, Chlorphenoxamine hydrochloride, 3UVD77BP8R, C18-H22-Cl-N-O, CID6475, CB10450, C100100, 2-[(p-chloro-alpha-methyl-alpha-phenylbenzyl)oxy]-N,N-dimethylethylamine,

Complexity	296
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	303.139g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	303.83g/mol
Monoisotopic Mass	303.139g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	12.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	4.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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