Hexanedioic acid, 3-oxo-, 1,6-dimethyl ester

CAS Registry Number®

5457-44-3
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CAS Name

Hexanedioic acid, 3-oxo-, 1,6-dimethyl ester

Molecular Formula

C8H12O5

Molecular Mass

188.18

Cite this Page

Hexanedioic acid, 3-oxo-, 1,6-dimethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=5457-44-3 (retrieved 2024-05-05) (CAS RN: 5457-44-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    122 °C @ Press: 0.5 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H12O5/c1-12-7(10)4-3-6(9)5-8(11)13-2/h3-5H2,1-2H3

InChIKey

InChIKey=CMGTZMRSJJKAPM-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Hexanedioic acid, 3-oxo-, 1,6-dimethyl ester
  • Hexanedioic acid, 3-oxo-, dimethyl ester
  • Dimethyl 3-oxohexanedioate
  • Dimethyl 3-oxoadipate
  • Dimethyl β-ketoadipate

CAS INSIGHTSTM
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