rel-(3R,4R)-3,4-Dihydro-7,12-dimethylbenz[a]anthracene-3,4-diol

CAS Registry Number®

68162-13-0
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CAS Name

rel-(3R,4R)-3,4-Dihydro-7,12-dimethylbenz[a]anthracene-3,4-diol

Molecular Formula

C20H18O2

Molecular Mass

290.36

Cite this Page

rel-(3R,4R)-3,4-Dihydro-7,12-dimethylbenz[a]anthracene-3,4-diol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=68162-13-0 (retrieved 2024-05-18) (CAS RN: 68162-13-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    182-184 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1/C20H18O2/c1-11-13-5-3-4-6-14(13)12(2)19-15(11)7-8-17-16(19)9-10-18(21)20(17)22/h3-10,18,20-22H,1-2H3/t18-,20-/s2

InChIKey

InChIKey=YZIIKMBFHLJAFT-MQEFSVKANA-N

SMILES

CC=1C2=C3C(=CC=C2C(C)=C4C1C=CC=C4)[C@H](O)[C@@H](O)C=C3

Canonical SMILES

OC1C=CC=2C(=CC=C3C2C(=C4C=CC=CC4=C3C)C)C1O

Other Names for this Substance

  • Benz[a]anthracene-3,4-diol, 3,4-dihydro-7,12-dimethyl-, (3R,4R)-rel-
  • Benz[a]anthracene-3,4-diol, 3,4-dihydro-7,12-dimethyl-, trans-
  • rel-(3R,4R)-3,4-Dihydro-7,12-dimethylbenz[a]anthracene-3,4-diol
  • trans-3,4-Dihydro-3,4-dihydroxy-7,12-dimethylbenz[a]anthracene
  • trans-3,4-Dihydroxy-3,4-dihydro-7,12-dimethylbenz[a]anthracene

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Deleted or Replaced CAS Registry Numbers

74938-86-6

CAS INSIGHTSTM
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