(-)-Candidone

CAS Registry Number®

77727-18-5
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CAS Name

(-)-Candidone

Molecular Formula

C22H24O4

Molecular Mass

352.42

Cite this Page

(-)-Candidone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=77727-18-5 (retrieved 2024-08-28) (CAS RN: 77727-18-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    97-100 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C22H24O4/c1-14(2)10-11-16-19(24-3)13-20(25-4)21-17(23)12-18(26-22(16)21)15-8-6-5-7-9-15/h5-10,13,18H,11-12H2,1-4H3/t18-/m0/s1

InChIKey

InChIKey=JYESOAFLKFHYHP-SFHVURJKSA-N

SMILES

O(C)C1=C2C(=C(CC=C(C)C)C(OC)=C1)O[C@@H](CC2=O)C3=CC=CC=C3

Canonical SMILES

O=C1C2=C(OC)C=C(OC)C(=C2OC(C=3C=CC=CC3)C1)CC=C(C)C

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dimethoxy-8-(3-methyl-2-buten-1-yl)-2-phenyl-, (2S)-
  • 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dimethoxy-8-(3-methyl-2-butenyl)-2-phenyl-, (S)-
  • 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dimethoxy-8-(3-methyl-2-butenyl)-2-phenyl-, (2S)-
  • (2S)-2,3-Dihydro-5,7-dimethoxy-8-(3-methyl-2-buten-1-yl)-2-phenyl-4H-1-benzopyran-4-one
  • Candidone

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