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Substance Name: Phenprocoumon [USAN:USP:INN:BAN]
RN: 435-97-2
UNII: Q08SIO485D
InChIKey: DQDAYGNAKTZFIW-UHFFFAOYSA-N

Note

  • Coumarin derivative that acts as a long acting oral anticoagulant.

Molecular Formula

  • C18-H16-O3

Molecular Weight

  • 280.321
 

Classification Codes

  • Anticoagulant
  • Anticoagulants
  • Hematologic Agents
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Names and Synonyms

Name of Substance

  • Phenprocoumon
  • Phenprocoumon [USAN:USP:INN:BAN]

MeSH Heading

  • Phenprocoumon

Synonyms

  • 2H-1-Benzopyran-2-one, 4-hydroxy-3-(1-phenylpropyl)-
  • 3-(1'-Phenyl-propyl)-4-oxycoumarin
  • 3-(1'-Phenyl-propyl)-4-oxycoumarin [German]
  • 3-(1-Phenylpropyl)-4-hydroxycoumarin
  • 3-(alpha-Ethylbenzyl)-4-hydroxycoumarin
  • 3-(alpha-Phenylpropyl)-4-hydroxycoumarin
  • 4-Hydroxy-3-(1-phenylpropyl)-2H-1-benzopyran-2-one
  • 5-18-02-00343 (Beilstein Handbook Reference)
  • BRN 1291115
  • Coumarin, 3-(alpha-ethylbenzyl)-4-hydroxy-
  • EINECS 207-108-9
  • Falithrom
  • Fencumar
  • Fenprocoumona
  • Fenprocoumona [INN-Spanish]
  • Fenprocumone
  • Fenprocumone [DCIT]
  • HSDB 3248
  • Liquamar
  • Marcoumar
  • Marcumar
  • Phenprocoumarol
  • Phenprocoumarole
  • Phenprocoumon
  • Phenprocoumone
  • Phenprocoumone [INN-French]
  • Phenprocoumonum
  • Phenprocoumonum [INN-Latin]
  • Phenprocumonum
  • Ro 1-4849
  • UNII-Q08SIO485D

Systematic Names

  • 2H-1-Benzopyran-2-one, 4-hydroxy-3-(1-phenylpropyl)-
  • Coumarin, 3-(alpha-ethylbenzyl)-4-hydroxy-
  • Phenprocoumon

Superlist Name

  • Phenprocoumon

Registry Numbers

CAS Registry Number

  • 435-97-2

FDA UNII

  • Q08SIO485D

System Generated Number

  • 0000435972

Structure Descriptors

InChI

1S/C18H16O3/c1-2-13(12-8-4-3-5-9-12)16-17(19)14-10-6-7-11-15(14)21-18(16)20/h3-11,13,19H,2H2,1H3

InChIKey

DQDAYGNAKTZFIW-UHFFFAOYSA-N

Smiles

c1([C@@H](c2ccccc2)CC)c(c2c(cccc2)oc1=O)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 179.5 deg C   EXP
log P (octanol-water) 3.62 (none)   EXP
Water Solubility 12.9 mg/L 25 EST
Vapor Pressure 7.75E-11 mm Hg 25 EST
Henry's Law Constant 4.50E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.89E-11 cm3/molecule-sec 25 EST

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