N-(5,5-Dimethyl-2-oxooxolan-3-yl)-4-fluorobenzamide
Basic information
- CAS
77694-31-6- Standard SMILES
CC1(C)CC(NC(=O)c2ccc(F)cc2)C(=O)O1- InChIKey
QRDJEPRUENASKA-UHFFFAOYSA-N- Molecular formula
- C13H14FNO3
- Average molar mass
- 251.25 g/mol
- Monoisotopic mass
- 251.09577147
Names & identifiers
- Preferred name
- N-(5,5-Dimethyl-2-oxooxolan-3-yl)-4-fluorobenzamide
- IUPAC
- N-(5,5-dimethyl-2-oxooxolan-3-yl)-4-fluorobenzamide
- English name
- BENZAMIDE, N-(5,5-DIMETHYL-2-OXOTETRAHYDRO-3-FURYL)-p-FLUORO-
- Molecular weight
- 0
Names & synonyms
77694-31-6N-(5,5-dimethyl-2-oxooxolan-3-yl)-4-fluorobenzamideDTXSID40998896RefChem:1091333DTXCID601425877N-(5,5-Dimethyl-2-Oxooxolan-3-yl-4-FluorobenzamideBRN 5545230N-(5,5-Dimethyl-2-oxotetrahydro-3-furyl)-p-fluorobenzamideBENZAMIDE, N-(5,5-DIMETHYL-2-OXOTETRAHYDRO-3-FURYL)-p-FLUORO-N-(5,5-Dimethyl-2-oxotetrahydrofuran-3-yl)-p-fluorobenzamide
Database identifiers
- CAS
77694-31-6- PubChem CID
- 53719
- DTXSID
DTXSID40998896- Nikkaji
- J149.112A
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 348
Physicochemical properties
- EWG's Food Scores
- 1 · 1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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