6-Methylbenzo[a]pyrene

CAS Registry Number®

2381-39-7

CAS Name

6-Methylbenzo[a]pyrene

Molecular Formula

C21H14

Molecular Mass

266.34

Cite this Page

6-Methylbenzo[a]pyrene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2381-39-7 (retrieved 2024-11-22) (CAS RN: 2381-39-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    171-171.5 °C

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=YFYHJNJCAGHSFA-UHFFFAOYSA-N

SMILES

CC1=C2C3=C4C(=CC=C3C=5C1=CC=CC5)C=CC=C4C=C2

Canonical SMILES

C=1C=CC2=C(C1)C3=CC=C4C=CC=C5C=CC(C3=C45)=C2C

Other Names for this Substance

  • Benzo[a]pyrene, 6-methyl-
  • 6-Methylbenzo[a]pyrene
  • 6-Methyl-3,4-benzopyrene