Completing data — usually done within a minute
Basic information
- CAS
18670-98-9- Standard SMILES
CC(NC(=O)OC(C)(C)C)C(=O)NC(C)C(=O)OCc1ccccc1- InChIKey
VXUVNSBXLFFECZ-UHFFFAOYSA-N- Molecular formula
- C18H26N2O5
- Average molar mass
- 350.4 g/mol
Names & identifiers
- Preferred name
- Benzyl 2-[2-(tert-butoxycarbonylamino)propanoylamino]propanoate
- IUPAC
- benzyl 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]propanoate
Names & synonyms
18670-98-934385-44-9NSC339936DTXSID20940136Benzyl 2-[2-(tert-butoxycarbonylamino)propanoylamino]propanoateNSC339935NSC-339935NSC-339936DS-007236N-[1-(Benzyloxy)-1-oxopropan-2-yl]-2-{[tert-butoxy(hydroxy)methylidene]amino}propanimidic acid
Database identifiers
- CAS
18670-98-9、34385-44-9- PubChem CID
- 334524
- DTXSID
DTXSID20940136
Properties
Computed structural propertiesFilling in
- XLogP
- 2.5
- Topological polar surface area
- 93.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 467
Related reactions
2 records
Compound notes
Loading…