Basic information
- CAS
70004-76-1- Standard SMILES
N[C@H](CN[C@@H](CC(=O)O)C(=O)O)C(=O)O- InChIKey
HKUWZGIXOSUJLV-DMTCNVIQSA-N- Molecular formula
- C7H12N2O6
- Average molar mass
- 220.18 g/mol
- Monoisotopic mass
- 220.06953611
Names & identifiers
- Preferred name
- L-Aspartic acid, N-(2-amino-2-carboxyethyl)-, (R)-
- IUPAC
- (2S)-2-[[(2R)-2-amino-2-carboxyethyl]amino]butanedioic acid
Names & synonyms
70004-76-1L-Aspartic acid, N-(2-amino-2-carboxyethyl)-, (R)-DTXSID90990249N-(2-Amino-2-carboxyethyl)aspartic acidN-[(2R)-2-amino-2-carboxyethyl]-L-aspartic acid
Database identifiers
- CAS
70004-76-1- PubChem CID
- 155348
- DTXSID
DTXSID90990249
Properties
Computed structural properties
- XLogP
- -6.9
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 266
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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