Basic information
- CAS
22902-31-4- Standard SMILES
Nc1ccccc1NC(=O)C(F)(F)F- InChIKey
YWBWHUHKSASUBK-UHFFFAOYSA-N- Molecular formula
- C8H7F3N2O
- Average molar mass
- 204.15 g/mol
- Monoisotopic mass
- 204.05104734
Names & identifiers
- Preferred name
- n-(2-Aminophenyl)-2,2,2-trifluoroacetamide
- IUPAC
- N-(2-aminophenyl)-2,2,2-trifluoroacetamide
- English name
- AcetaMide, N-(2-aMinophenyl)-2,2,2-trifluoro-
- Molecular formula
- C8H7F3N2O
- Molecular weight
- 204.15
Names & synonyms
n-(2-aminophenyl)-2,2,2-trifluoroacetamide22902-31-4Acetamide, N-(2-aminophenyl)-2,2,2-trifluoro-NSC103789SCHEMBL3846828DTXSID50295666YWBWHUHKSASUBK-UHFFFAOYSA-NAKOS012406880NSC-103789DS-006224
Database identifiers
- CAS
22902-31-4- PubChem CID
- 266342
- DTXSID
DTXSID50295666- Nikkaji
- J1.345.194J
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 217
Physicochemical properties
- Boiling point
- 297.2 · 297.2±40.0 °C(Predicted)
- Density
- 1.445 · 1.445±0.06 g/cm3(Predicted)
- pka
- 9.66 · 9.66±0.70(Predicted)
Chemistry & industry
Suppliers1 total
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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