Difenacoum
CAS Registry Number®
56073-07-5
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CAS Name
DifenacoumMolecular Formula
C31H24O3Molecular Mass
444.52Cite this Page
Difenacoum. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=56073-07-5 (retrieved ) (CAS RN: 56073-07-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
228-232 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1S/C31H24O3/c32-30-26-12-6-7-13-28(26)34-31(33)29(30)27-19-24(18-23-10-4-5-11-25(23)27)22-16-14-21(15-17-22)20-8-2-1-3-9-20/h1-17,24,27,32H,18-19H2
InChIKey
InChIKey=FVQITOLOYMWVFU-UHFFFAOYSA-N
SMILES
OC1=C(C2C=3C(CC(C2)C4=CC=C(C=C4)C5=CC=CC=C5)=CC=CC3)C(=O)OC=6C1=CC=CC6
Canonical SMILES
O=C1OC=2C=CC=CC2C(O)=C1C3C=4C=CC=CC4CC(C=5C=CC(=CC5)C=6C=CC=CC6)C3
Other Names for this Substance
- 2H-1-Benzopyran-2-one, 3-(3-[1,1′-biphenyl]-4-yl-1,2,3,4-tetrahydro-1-naphthalenyl)-4-hydroxy-
- 3-(3-[1,1′-Biphenyl]-4-yl-1,2,3,4-tetrahydro-1-naphthalenyl)-4-hydroxy-2H-1-benzopyran-2-one
- Difenacoum
- Neosorexa
- Diphenacoum
