(((2,2,5,5-Tetrakis(trifluoromethyl)-1,3-oxazolidin-4-yl)carbonyl)amino)acetic acid
Basic information
- CAS
36871-69-9- Standard SMILES
O=C(O)CNC(=O)C1NC(C(F)(F)F)(C(F)(F)F)OC1(C(F)(F)F)C(F)(F)F- InChIKey
SMOIGBFAZZYOSZ-UHFFFAOYSA-N- Molecular formula
- C10H6F12N2O4
- Average molar mass
- 446.15 g/mol
- Monoisotopic mass
- 446.0135946
Names & identifiers
- Preferred name
- (((2,2,5,5-Tetrakis(trifluoromethyl)-1,3-oxazolidin-4-yl)carbonyl)amino)acetic acid
- IUPAC
- 2-[[2,2,5,5-tetrakis(trifluoromethyl)-1,3-oxazolidine-4-carbonyl]amino]acetic acid
Names & synonyms
NSC16039136871-69-9n-{[2,2,5,5-tetrakis(trifluoromethyl)-1,3-oxazolidin-4-yl]carbonyl}glycineNSC-160391(((2,2,5,5-tetrakis(trifluoromethyl)-1,3-oxazolidin-4-yl)carbonyl)amino)acetic acidCHEMBL1968219DTXSID20303702NCI60_001192DS-007681Glycine, N-[[2,2,5,5-tetrakis(trifluoromethyl)-4-oxazolidinyl]carbonyl]-?N-[2,2,5,5-Tetrakis(trifluoromethyl)-1,3-oxazolidine-4-carbonyl]glycine2-[[2,2,5,5-tetrakis(trifluoromethyl)oxazolidine-4-carbonyl]amino]acetic acid
Database identifiers
- CAS
36871-69-9- PubChem CID
- 293597
- DTXSID
DTXSID20303702- ChEMBL
CHEMBL1968219
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 87.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 17
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 606
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…