Cas no 16760-45-5 (13-cis Retinoic Acid Methyl Ester)

13-cis Retinoic Acid Methyl Ester structure
16760-45-5 structure
Product Name:13-cis Retinoic Acid Methyl Ester
CAS No:16760-45-5
MF:C21H30O2
MW:314.461706638336
CID:201744
PubChem ID:10448377
Update Time:2025-04-19

13-cis Retinoic Acid Methyl Ester Chemical and Physical Properties

Names and Identifiers

    • Retinoic acid, methylester, 13-cis-
    • methyl (2Z,4E,6Z,8Z)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)no na-2,4,6,8-tetraenoate
    • 13-cis Retinoic Acid Methyl Ester
    • 9-cis-Methyl Retinoate
    • 9-cis-Retinoic Acid Methyl Ester
    • methyl (2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate
    • 16760-45-5
    • SCHEMBL17769828
    • Methyl 13-cis-Retinoate
    • 13-cis-Methyl retinoate
    • Inchi: 1S/C21H30O2/c1-16(9-7-10-17(2)15-20(22)23-6)12-13-19-18(3)11-8-14-21(19,4)5/h7,9-10,12-13,15H,8,11,14H2,1-6H3/b10-7+,13-12+,16-9+,17-15-
    • InChI Key: SREQLAJQLXPNMC-WYSPNRNQSA-N
    • SMILES: O(C)C(/C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C)=O

Computed Properties

  • Exact Mass: 314.22500
  • Monoisotopic Mass: 314.224580195g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 6
  • Complexity: 581
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 4
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 6.6
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • Stability/Shelf Life: At 00C.
  • PSA: 26.30000
  • LogP: 5.69100

13-cis Retinoic Acid Methyl Ester Pricemore >>

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13-cis Retinoic Acid Methyl Ester Production Method

13-cis Retinoic Acid Methyl Ester Related Literature

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