Basic information
- Standard SMILES
CCCC(C)(CC(=O)O)CC(=O)O- InChIKey
DQUACPPWSVJDOW-UHFFFAOYSA-N- Molecular formula
- C9H16O4
- Average molar mass
- 188.22 g/mol
- Monoisotopic mass
- 188.10485899
Names & identifiers
- Preferred name
- 3-Methyl-3-n-propylglutaric Acid
- IUPAC
- 3-methyl-3-propylpentanedioic acid
Names & synonyms
SCHEMBL4742763DQUACPPWSVJDOW-UHFFFAOYSA-N3-Methyl-3-n-propylglutaric AcidDB-10567180721-12-6
Database identifiers
- PubChem CID
- 12937423
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 182
Related reactions
1 records
Compound notes
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