Basic information
- CAS
218930-20-2- Standard SMILES
CC(=O)CC(=O)Nc1ccc(F)cc1F- InChIKey
CNAPKPKZXWZLMD-UHFFFAOYSA-N- Molecular formula
- C10H9F2NO2
- Average molar mass
- 213.18 g/mol
- Monoisotopic mass
- 213.06013485
Names & identifiers
- Preferred name
- N-(2,4-difluorophenyl)-3-oxobutanamide
- IUPAC
- N-(2,4-difluorophenyl)-3-oxobutanamide
- English name
- N-(2,4-difluorophenyl)-3-oxobutanamide
- Molecular formula
- C10H9F2NO2
- Molecular weight
- 213.18
Names & synonyms
N-(2,4-difluorophenyl)-3-oxobutanamide218930-20-2MFCD00828654CBMicro_045500DTXSID40353224STL090843AKOS000166339BS-36623BIM-0045513.P001CS-0328312ST51017191F314795
Show more names
UKRORGSYN-BB BBV-055323Butanamide, N-(2,4-difluorophenyl)-3-oxo-N-(2,4-difluorophenyl)-3-oxobutanamide(SALTDATA: FREE)
N-[2,4-bis(fluoranyl)phenyl]-3-oxidanylidene-butanamide
Database identifiers
- CAS
218930-20-2- PubChem CID
- 737293
- DTXSID
DTXSID40353224
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 258
Physicochemical properties
- Boiling point
- 348.5 · 348.5±42.0 °C(Predicted)
- Density
- 1.323 · 1.323±0.06 g/cm3(Predicted)
- pka
- 10.72 · 10.72±0.46(Predicted)
Chemistry & industry
Suppliers2 total
CHEMBRDG-BB[email protected]
UKRORGSYN-BB[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…