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Substance Name: 1,2-Dihydro-1,2-dihydroxy-12-fluoro-5-methylchrysene
RN: 92755-76-5
InChIKey: BXZAZFRAVKHYLN-APWZRJJASA-N

Note

  • Possible metabolite of 12-fluoro-5-methylchrysene.

Molecular Weight

  • 294.323
 
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Names and Synonyms

Name of Substance

  • 1,2-Dihydro-1,2-dihydroxy-12-fluoro-5-methylchrysene

Synonym

  • 12-F-5-Mec-1,2-diol

Systematic Name

  • 1,2-Chrysenediol, 12-fluoro-1,2-dihydro-5-methyl-, trans-

Registry Numbers

CAS Registry Number

  • 92755-76-5

System Generated Number

  • 0092755765

Structure Descriptors

InChI

1S/C19H15FO2/c1-10-8-11-4-2-3-5-12(11)14-9-15(20)18-13(17(10)14)6-7-16(21)19(18)22/h2-9,16,19,21-22H,1H3/t16-,19+/m1/s1

InChIKey

BXZAZFRAVKHYLN-APWZRJJASA-N

Smiles

C=1[C@H]([C@@H](c2c(cc3c4ccccc4cc(c3c2C1)C)F)O)O