N~2~-(Trifluoroacetyl)asparagine
Basic information
- CAS
35146-48-6- Standard SMILES
NC(=O)CC(NC(=O)C(F)(F)F)C(=O)O- InChIKey
BJMXKMSTCRAHAJ-UHFFFAOYSA-N- Molecular formula
- C6H7F3N2O4
- Average molar mass
- 228.13 g/mol
- Monoisotopic mass
- 228.0357912
Names & identifiers
- Preferred name
- N~2~-(Trifluoroacetyl)asparagine
- IUPAC
- 4-amino-4-oxo-2-[(2,2,2-trifluoroacetyl)amino]butanoic acid
Names & synonyms
3-carbamoyl-2-(trifluoroacetamido)propanoic acid455-45-8N~2~-(Trifluoroacetyl)asparagineNSC522627SCHEMBL6620751DTXSID70307553NSC192715NSC-192715NSC-522627EN300-932112
Database identifiers
- CAS
35146-48-6- PubChem CID
- 303589
- DTXSID
DTXSID70307553
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 289
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…