{2-[Benzyl(2,2,2-trifluoroethyl)amino]-2-oxoethoxy}acetic acid
Basic information
- CAS
1305790-00-4- Standard SMILES
O=C(O)COCC(=O)N(Cc1ccccc1)CC(F)(F)F- InChIKey
RDNAXJSTVHVNKK-UHFFFAOYSA-N- Molecular formula
- C13H14F3NO4
- Average molar mass
- 305.25 g/mol
- Monoisotopic mass
- 305.08749241
Names & identifiers
- Preferred name
- {2-[Benzyl(2,2,2-trifluoroethyl)amino]-2-oxoethoxy}acetic acid
- IUPAC
- 2-[2-[benzyl(2,2,2-trifluoroethyl)amino]-2-oxoethoxy]acetic acid
Names & synonyms
DTXSID601150523AKOS010583707{2-[Benzyl(2,2,2-trifluoroethyl)amino]-2-oxoethoxy}acetic acid2-[2-Oxo-2-[(phenylmethyl)(2,2,2-trifluoroethyl)amino]ethoxy]acetic acid1305790-00-4
Database identifiers
- CAS
1305790-00-4- PubChem CID
- 61329038
- DTXSID
DTXSID601150523
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 354
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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