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Substance Name: Chlorphenoxamine [INN:BAN]
RN: 77-38-3
UNII: 3UVD77BP8R
InChIKey: KKHPNPMTPORSQE-UHFFFAOYSA-N

Classification Codes

  • Cholinergic Agents
  • Cholinergic Antagonists
  • Drug / Therapeutic Agent
  • Histamine Agents
  • Histamine Antagonists
  • Muscarinic Antagonists
  • Neurotransmitter Agents

Molecular Formula

  • C18-H22-Cl-N-O

Molecular Weight

  • 303.831
 
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Names and Synonyms

Results Name

  • Chlorphenoxamine [INN:BAN]

Name of Substance

  • Chlorphenoxamine
  • Chlorphenoxamine [INN:BAN]

Synonyms

  • 2-(1-(p-Chlorophenyl)-1-phenylethoxy)-N,N-dimethylethylamine
  • 4-06-00-04717 (Beilstein Handbook Reference)
  • beta-Dimethylamino-aethyl-(p-chlor-alpha-methylbenzhydryl)-aether
  • beta-Dimethylamino-aethyl-(p-chlor-alpha-methylbenzhydryl)-aether [German]
  • BRN 2057618
  • Chlorphenoxamine
  • Chlorphenoxaminum
  • Chlorphenoxaminum [INN-Latin]
  • Clorfenossamina
  • Clorfenossamina [DCIT]
  • Clorfenoxamina
  • Clorfenoxamina [INN-Spanish]
  • Contristamine
  • EC 616-456-4
  • p-Chlor-alpha-methyl-diphenhydramin
  • p-Chlor-alpha-methyl-diphenhydramin [German]
  • UNII-3UVD77BP8R

Systematic Names

  • Ethanamine, 2-(1-(4-chlorophenyl)-1-phenylethoxy)-N,N-dimethyl-
  • Ethanamine, 2-(1-(4-chlorophenyl)-1-phenylethoxy)-N,N-dimethyl- (9CI)
  • Ethylamine, 2-(1-(p-chlorophenyl)-1-phenylethoxy)-N,N-dimethyl-

Registry Numbers

CAS Registry Number

  • 77-38-3

FDA UNII

  • 3UVD77BP8R

Related Registry Number

  • 562-09-4 (hydrochloride)

System Generated Number

  • 0000077383

Structure Descriptors

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

InChIKey

KKHPNPMTPORSQE-UHFFFAOYSA-N

Smiles

c1([C@@](c2ccccc2)(OCCN(C)C)C)ccc(Cl)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 167mg/kg (167mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 7, Pg. 237, 1957.
mouse LD50 oral 376mg/kg (376mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 7, Pg. 237, 1957.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 4.200 (none)   EST
Atmospheric OH Rate Constant 1.12E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.