Basic information
- Standard SMILES
CC(C)(C)CCN[C@H]1CC(=O)OC1=O- InChIKey
VPWQPCHUYPTPRO-ZETCQYMHSA-N- Molecular formula
- C10H17NO3
- Average molar mass
- 199.25 g/mol
- Monoisotopic mass
- 199.1208434
Names & identifiers
- Preferred name
- N-neohexyl-L-aspartic anhydride
- IUPAC
- (3S)-3-(3,3-dimethylbutylamino)oxolane-2,5-dione
Names & synonyms
SCHEMBL7096214N-neohexyl-L-aspartic anhydrideVPWQPCHUYPTPRO-ZETCQYMHSA-N
Database identifiers
- PubChem CID
- 11217864
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 242
Related reactions
2 records
Compound notes
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