methyl (2S)-5-amino-2-(benzoylamino)pentanoate hydrochloride
Basic information
- CAS
840-98-2- Standard SMILES
COC(=O)C(CCCN)NC(=O)c1ccccc1.Cl- InChIKey
VSZDXWVVQBAOMW-UHFFFAOYSA-N- Molecular formula
- C13H19ClN2O3
- Average molar mass
- 286.75 g/mol
- Monoisotopic mass
- 286.1084202
Names & identifiers
- Preferred name
- methyl (2S)-5-amino-2-(benzoylamino)pentanoate hydrochloride
- IUPAC
- methyl 5-amino-2-benzamidopentanoate;hydrochloride
Names & synonyms
840-98-2DTXSID80639291NSC334209AKOS024324492NSC-334209Methyl N~2~-benzoylornithinate--hydrogen chloride (1/1)methyl (2S)-5-amino-2-(benzoylamino)pentanoate hydrochloride
Database identifiers
- CAS
840-98-2- PubChem CID
- 24199554
- DTXSID
DTXSID80639291
Properties
Computed structural properties
- Topological polar surface area
- 81.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 275
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…