8-Methylbenzo[a]pyrene

CAS Registry Number®

63041-76-9
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CAS Name

8-Methylbenzo[a]pyrene

Molecular Formula

C21H14

Molecular Mass

266.34

Cite this Page

8-Methylbenzo[a]pyrene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=63041-76-9 (retrieved 2024-05-18) (CAS RN: 63041-76-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    217.5-218 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H14/c1-13-5-9-18-17(11-13)12-16-7-6-14-3-2-4-15-8-10-19(18)21(16)20(14)15/h2-12H,1H3

InChIKey

InChIKey=DYXXRXZXTKRLFX-UHFFFAOYSA-N

SMILES

CC=1C=C2C(C=3C4=C5C(=CC3)C=CC=C5C=CC4=C2)=CC1

Canonical SMILES

C=1C=C2C=CC3=CC=4C=C(C=CC4C=5C=CC(C1)=C2C35)C

Other Names for this Substance

  • Benzo[a]pyrene, 8-methyl-
  • 8-Methylbenzo[a]pyrene

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