(±)-3-Methyladipic acid
CAS Registry Number®
3058-01-3
CAS Name
(±)-3-Methyladipic acidMolecular Formula
C7H12O4Molecular Mass
160.17Cite this Page
(±)-3-Methyladipic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=3058-01-3 (retrieved ) (CAS RN: 3058-01-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
220-222 °C @ Press: 18 TorrMelting Point (2)
101 °C
Source(s)
- (1) v. Braun, Julius; Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen, (1926), 59B, 1091-6, CAplus
- (2) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C7H12O4/c1-5(4-7(10)11)2-3-6(8)9/h5H,2-4H2,1H3,(H,8,9)(H,10,11)
InChIKey
InChIKey=SYEOWUNSTUDKGM-UHFFFAOYSA-N
SMILES
C(CCC(O)=O)(CC(O)=O)C
Canonical SMILES
O=C(O)CCC(C)CC(=O)O
Other Names for this Substance
- Hexanedioic acid, 3-methyl-
- Adipic acid, β-methyl-
- 3-Methylhexanedioic acid
- β-Methyladipic acid
- 3-Methyladipic acid
Deleted or Replaced CAS Registry Numbers
81177-02-8
