3-Benzyl-4-hydroxycoumarin

CAS Registry Number®

15074-18-7

CAS Name

3-Benzyl-4-hydroxycoumarin

Molecular Formula

C16H12O3

Molecular Mass

252.26

Cite this Page

3-Benzyl-4-hydroxycoumarin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=15074-18-7 (retrieved 2024-11-22) (CAS RN: 15074-18-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    205 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H12O3/c17-15-12-8-4-5-9-14(12)19-16(18)13(15)10-11-6-2-1-3-7-11/h1-9,17H,10H2

InChIKey

InChIKey=AEIVRFFWQSJCAR-UHFFFAOYSA-N

SMILES

OC=1C=2C(OC(=O)C1CC3=CC=CC=C3)=CC=CC2

Canonical SMILES

O=C1OC=2C=CC=CC2C(O)=C1CC=3C=CC=CC3

Other Names for this Substance

  • 2H-1-Benzopyran-2-one, 4-hydroxy-3-(phenylmethyl)-
  • Coumarin, 3-benzyl-4-hydroxy-
  • 4-Hydroxy-3-(phenylmethyl)-2H-1-benzopyran-2-one
  • 3-Benzyl-4-hydroxycoumarin
  • 4-Hydroxy-3-benzylcoumarin

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