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Substance Name: Bephenium
RN: 7181-73-9
UNII: PXO9B4983I
InChIKey: AVWWVJUMXRXPNF-UHFFFAOYSA-N

Molecular Formula

  • C17-H22-N-O

Molecular Weight

  • 256.367
 
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Names and Synonyms

Name of Substance

  • Bephenium

Synonyms

  • Ammonium, benzyldimethyl(2-phenoxyethyl)-
  • Benzenemethanaminium, N,N-dimethyl-N-(2-phenoxyethyl)-
  • Bephenium
  • Bephenum
  • BRN 4143098
  • EINECS 230-546-7
  • HSDB 3207
  • N,N-Dimethyl-N-(2-phenoxyethyl)-benzenemethanaminium
  • UNII-PXO9B4983I

Systematic Names

  • Ammonium, benzyldimethyl(2-phenoxyethyl)-
  • Benzyldimethyl(2-phenoxyethyl)ammonium

Registry Numbers

CAS Registry Number

  • 7181-73-9

FDA UNII

  • PXO9B4983I

System Generated Number

  • 0007181739

Structure Descriptors

InChI

1S/C17H22NO/c1-18(2,15-16-9-5-3-6-10-16)13-14-19-17-11-7-4-8-12-17/h3-12H,13-15H2,1-2H3/q+1

InChIKey

AVWWVJUMXRXPNF-UHFFFAOYSA-N

Smiles

c1(C[N+](CCOc2ccccc2)(C)C)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 7880mg/kg (7880mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 17, Pg. 321, 1961.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.510 (none)   EST
Atmospheric OH Rate Constant 7.50E-11 cm3/molecule-sec 25 EST

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