Basic information
- Standard SMILES
CCCCCCCCCCCCC(=O)NC(CC(=O)O)C(=O)O- InChIKey
AQYMDIXUGPPEDC-UHFFFAOYSA-N- Molecular formula
- C17H31NO5
- Average molar mass
- 329.4 g/mol
- Monoisotopic mass
- 329.22022309
Names & identifiers
- Preferred name
- 2-(Tridecanoylamino)butanedioic acid
- IUPAC
- 2-(tridecanoylamino)butanedioic acid
Names & synonyms
SCHEMBL27934240
Database identifiers
- PubChem CID
- 19368985
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 15
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 357
Related reactions
1 records
Compound notes
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