7-Methylbenzo[a]pyrene

CAS Registry Number®

63041-77-0
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CAS Name

7-Methylbenzo[a]pyrene

Molecular Formula

C21H14

Molecular Mass

266.34

Cite this Page

7-Methylbenzo[a]pyrene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=63041-77-0 (retrieved 2024-05-06) (CAS RN: 63041-77-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    188-189 °C

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=PYVWGNPFWVQISD-UHFFFAOYSA-N

SMILES

CC1=C2C(C=3C4=C5C(=CC3)C=CC=C5C=CC4=C2)=CC=C1

Canonical SMILES

C=1C=C2C=CC3=CC4=C(C=CC=C4C)C=5C=CC(C1)=C2C35

Other Names for this Substance

  • Benzo[a]pyrene, 7-methyl-
  • 7-Methylbenzo[a]pyrene

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