Basic information
- Standard SMILES
Cl.NCC(=O)CCC(=O)OCCCCCCCC(=O)O- InChIKey
WEQQQUTVFNKORT-UHFFFAOYSA-N- Molecular formula
- C13H24ClNO5
- Average molar mass
- 309.78 g/mol
Names & identifiers
- Preferred name
- 7-Carboxyheptyl 5-amino-4-oxopentanoate hydrochloride
- IUPAC
- 8-(5-amino-4-oxopentanoyl)oxyoctanoic acid;hydrochloride
Names & synonyms
SCHEMBL15561322WEQQQUTVFNKORT-UHFFFAOYSA-N7-carboxyheptyl 5-amino-4-oxopentanoate hydrochloride
Database identifiers
- PubChem CID
- 90034497
Properties
Computed structural properties
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 291
Related reactions
1 records
Compound notes
Loading…