Meclorisone

CAS Registry Number®

4732-48-3

CAS Name

Meclorisone

Molecular Formula

C22H28Cl2O4

Molecular Mass

427.36

Cite this Page

Meclorisone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4732-48-3 (retrieved 2024-11-24) (CAS RN: 4732-48-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    224-227 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H28Cl2O4/c1-12-8-16-15-5-4-13-9-14(26)6-7-19(13,2)21(15,24)17(23)10-20(16,3)22(12,28)18(27)11-25/h6-7,9,12,15-17,25,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1

InChIKey

InChIKey=OKWSMPYQIYKVDC-CXSFZGCWSA-N

SMILES

Cl[C@@]12[C@]([C@]3([C@](C)(C[C@@H]1Cl)[C@](C(CO)=O)(O)[C@H](C)C3)[H])(CCC=4[C@]2(C)C=CC(=O)C4)[H]

Canonical SMILES

O=C1C=CC2(C(=C1)CCC3C4CC(C)C(O)(C(=O)CO)C4(C)CC(Cl)C32Cl)C

Other Names for this Substance

  • Pregna-1,4-diene-3,20-dione, 9,11-dichloro-17,21-dihydroxy-16-methyl-, (11β,16α)-
  • Pregna-1,4-diene-3,20-dione, 9,11β-dichloro-17,21-dihydroxy-16α-methyl-
  • (11β,16α)-9,11-Dichloro-17,21-dihydroxy-16-methylpregna-1,4-diene-3,20-dione
  • 16α-Methyldichlorisone
  • Meclorisone

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