Penicillic acid

CAS Registry Number®

90-65-3

CAS Name

Penicillic acid

Molecular Formula

C8H10O4

Molecular Mass

170.16

Cite this Page

Penicillic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=90-65-3 (retrieved 2024-11-28) (CAS RN: 90-65-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    83-84 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C8H10O4/c1-5(2)8(11)6(12-3)4-7(9)10/h4H,1H2,2-3H3,(H,9,10)

InChIKey

InChIKey=VOUGEZYPVGAPBB-UHFFFAOYSA-N

SMILES

C(C(C(C)=C)=O)(=CC(O)=O)OC

Canonical SMILES

O=C(O)C=C(OC)C(=O)C(=C)C

Other Names for this Substance

  • 2,5-Hexadienoic acid, 3-methoxy-5-methyl-4-oxo-
  • Penicillic acid
  • 3-Methoxy-5-methyl-4-oxo-2,5-hexadienoic acid
  • γ-keto-β-Methoxy-δ-methylene-Δα-hexenoic acid
  • NSC 402844

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