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Substance Name: Benzo(a)pyrene, 9-(chloromethyl)-
RN: 123358-40-7
InChIKey: AXRLXMKDCUTHNH-UHFFFAOYSA-N

Molecular Formula

  • C21-H13-Cl

Molecular Weight

  • 300.787
 
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Names and Synonyms

Synonym

  • 9-(Chloromethyl)benzo(a)pyrene

Systematic Name

  • Benzo(a)pyrene, 9-(chloromethyl)-

Registry Numbers

CAS Registry Number

  • 123358-40-7

System Generated Number

  • 0123358407

Structure Descriptors

InChI

1S/C21H13Cl/c22-12-13-4-5-16-11-17-7-6-14-2-1-3-15-8-9-18(19(16)10-13)21(17)20(14)15/h1-11H,12H2

InChIKey

AXRLXMKDCUTHNH-UHFFFAOYSA-N

Smiles

c12c(cc3ccc4cccc5ccc1c3c45)ccc(c2)CCl