(±)-Warfarin sodium

CAS Registry Number®

129-06-6

CAS Name

(±)-Warfarin sodium

Molecular Formula

C19H16O4.Na

Cite this Page

(±)-Warfarin sodium.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=129-06-6 (retrieved 2024-11-22) (CAS RN: 129-06-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    160 °C

  • Density (2)

    1.3128 g/cm³ (solid)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C19H16O4.Na/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22;/h2-10,15,21H,11H2,1H3;

InChIKey

InChIKey=FSSPYKRRYDTFQZ-UHFFFAOYSA-N

SMILES

C(CC(C)=O)(C1=C(O)C=2C(OC1=O)=CC=CC2)C3=CC=CC=C3.[Na]

Canonical SMILES

[Na].O=C1OC=2C=CC=CC2C(O)=C1C(C=3C=CC=CC3)CC(=O)C

Other Names for this Substance

  • 2H-1-Benzopyran-2-one, 4-hydroxy-3-(3-oxo-1-phenylbutyl)-, sodium salt (1:1)
  • Coumarin, 3-(α-acetonylbenzyl)-4-hydroxy-, sodium salt
  • 2H-1-Benzopyran-2-one, 4-hydroxy-3-(3-oxo-1-phenylbutyl)-, sodium salt
  • Warfarin, sodium deriv.
  • 3-(α-Acetonylbenzyl)-4-hydroxycoumarin sodium

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Deleted or Replaced CAS Registry Numbers

12795-55-0, 51821-81-9, 859043-62-2

CAS INSIGHTSTM
Targeted protein degrader structure, illustration