Methyl 3,5-diamino-3-hydroxy-5-oxopentanoate
Basic information
- CAS
6937-08-2- Standard SMILES
COC(=O)CC(N)(O)CC(N)=O- InChIKey
YXXZZIXFUHVJJW-UHFFFAOYSA-N- Molecular formula
- C6H12N2O4
- Average molar mass
- 176.17 g/mol
- Monoisotopic mass
- 176.07970687
Names & identifiers
- Preferred name
- Methyl 3,5-diamino-3-hydroxy-5-oxopentanoate
- IUPAC
- methyl 3,5-diamino-3-hydroxy-5-oxopentanoate
Names & synonyms
6937-08-2methyl 3,5-diamino-3-hydroxy-5-oxopentanoateNSC40154DTXSID90284993NSC-40154
Database identifiers
- CAS
6937-08-2- PubChem CID
- 236994
- DTXSID
DTXSID90284993
Properties
Computed structural properties
- XLogP
- -2.7
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 194
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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