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Substance Name: 1,2-Anthracenediol, 4-bromo-1,2,3,4-tetrahydro-, dibenzoate, (1alpha,2beta,4alpha)-
RN: 60967-92-2
InChIKey: RTFYGNICURMWRN-GSDHBNRESA-N

Molecular Formula

  • C28-H21-Br-O4

Molecular Weight

  • 501.374
 
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Names and Synonyms

Synonym

  • 4-Bromo-1,2,3,4-tetrahydro-1,2-anthracenediol dibenzoate, (1alpha,2beta,4alpha)-

Systematic Name

  • 1,2-Anthracenediol, 4-bromo-1,2,3,4-tetrahydro-, dibenzoate, (1alpha,2beta,4alpha)-

Registry Numbers

CAS Registry Number

  • 60967-92-2

System Generated Number

  • 0060967922

Structure Descriptors

InChI

1S/C28H21BrO4/c29-24-17-25(32-27(30)18-9-3-1-4-10-18)26(33-28(31)19-11-5-2-6-12-19)23-16-21-14-8-7-13-20(21)15-22(23)24/h1-16,24-26H,17H2/t24-,25-,26-/m0/s1

InChIKey

RTFYGNICURMWRN-GSDHBNRESA-N

Smiles

C1[C@@H]([C@H](c2cc3ccccc3cc2[C@H]1Br)OC(c1ccccc1)=O)OC(c1ccccc1)=O