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Substance Name: Benz(a)anthracene-3,4-diol, 1-bromo-1,2,3,4-tetrahydro-, diacetate
RN: 80399-25-3
InChIKey: UVOQAGPPNJETDR-UHFFFAOYSA-N

Molecular Formula

  • C22-H19-Br-O4

Molecular Weight

  • 427.292
 
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Names and Synonyms

  • Benz(a)anthracene-3,4-diol, 1-bromo-1,2,3,4-tetrahydro-, diacetate

Registry Numbers

CAS Registry Number

  • 80399-25-3

System Generated Number

  • 0080399253

Structure Descriptors

InChI

1S/C22H19BrO4/c1-12(24)26-20-11-19(23)21-17(22(20)27-13(2)25)8-7-16-9-14-5-3-4-6-15(14)10-18(16)21/h3-10,19-20,22H,11H2,1-2H3

InChIKey

UVOQAGPPNJETDR-UHFFFAOYSA-N

Smiles

c12c(ccc3cc4ccccc4cc13)[C@@H]([C@@H](C[C@@H]2Br)OC(C)=O)OC(C)=O