9-Hydroxybenzo[a]pyrene

CAS Registry Number®

17573-21-6
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CAS Name

9-Hydroxybenzo[a]pyrene

Molecular Formula

C20H12O

Molecular Mass

268.31

Cite this Page

9-Hydroxybenzo[a]pyrene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=17573-21-6 (retrieved 2024-05-17) (CAS RN: 17573-21-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    196 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C20H12O/c21-16-8-6-14-10-15-5-4-12-2-1-3-13-7-9-17(18(14)11-16)20(15)19(12)13/h1-11,21H

InChIKey

InChIKey=OBBBXCAFTKLFGZ-UHFFFAOYSA-N

SMILES

OC=1C=C2C=3C4=C5C(=CC3)C=CC=C5C=CC4=CC2=CC1

Canonical SMILES

OC=1C=CC=2C=C3C=CC4=CC=CC=5C=CC(C2C1)=C3C45

Other Names for this Substance

  • Benzo[a]pyren-9-ol
  • 9-Hydroxybenzo[a]pyrene

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