Retinoic acid, 4-oxo-, methyl ester

CAS Registry Number®

38030-58-9
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CAS Name

Retinoic acid, 4-oxo-, methyl ester

Molecular Formula

C21H28O3

Molecular Mass

328.45

Cite this Page

Retinoic acid, 4-oxo-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=38030-58-9 (retrieved 2024-04-25) (CAS RN: 38030-58-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    90-91 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H28O3/c1-15(8-7-9-16(2)14-20(23)24-6)10-11-18-17(3)19(22)12-13-21(18,4)5/h7-11,14H,12-13H2,1-6H3/b9-7+,11-10+,15-8+,16-14+

InChIKey

InChIKey=VTSFDGSDUILKPM-XPSLGPGOSA-N

SMILES

C(=C/C(=C/C=C/C(=C/C(OC)=O)/C)/C)\C=1C(C)(C)CCC(=O)C1C

Canonical SMILES

O=C(OC)C=C(C=CC=C(C=CC1=C(C(=O)CCC1(C)C)C)C)C

Other Names for this Substance

  • Retinoic acid, 4-oxo-, methyl ester
  • Methyl 4-ketoretinoate
  • Methyl 4-oxoretinoate

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