2-Methylene-4-methylglutaric acid

Substructure search Find similar structures

Basic information

CAS: 3290-56-0
Standard SMILES: C=C(CC(C)C(=O)O)C(=O)O
InChIKey: CTAVNGXKBDENRF-UHFFFAOYSA-N
Molecular formula: C7H10O4
Average molar mass: 158.15 g/mol
Monoisotopic mass: 158.0579088

Names & identifiers

Preferred name: 2-Methylene-4-methylglutaric acid
IUPAC: 2-methyl-4-methylidenepentanedioic acid

Names & synonyms

2-methylene-4-methylglutaric acid2-methyl-4-methylenepentanedioic acid2-methyl-4-methylidenepentanedioic acid3290-56-0SCHEMBL3045176CTAVNGXKBDENRF-UHFFFAOYSA-NDTXSID601288081

Database identifiers

CAS: 3290-56-0
PubChem CID: 19784052
DTXSID: DTXSID601288081
Nikkaji: J707.620G

Properties

Computed structural properties

XLogP: 0.7
Topological polar surface area: 74.6 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 4
Heavy atoms: 11
Formal charge: 0
Complexity: 195

Related reactions

2 records

New reaction record

HRID 614673As productuspto-grants-1979_03

HRID 614674As productuspto-grants-1979_03

Compound notes

Loading…