4-Methyl-3-nitro-benzoyl fluoride
Completing data — refresh the page later to see the latest
Basic information
- CAS
80277-50-5- Standard SMILES
Cc1ccc(C(=O)F)cc1[N+](=O)[O-]- InChIKey
YSXWQZSNGUWEEE-UHFFFAOYSA-N- Molecular formula
- C8H6FNO3
- Average molar mass
- 183.14 g/mol
- Monoisotopic mass
- 183.03317122
Names & identifiers
- Preferred name
- 4-Methyl-3-nitro-benzoyl fluoride
- IUPAC
- 4-methyl-3-nitrobenzoyl fluoride
- English name
- Benzoyl fluoride, 4-methyl-3-nitro- (9CI)
- Molecular formula
- C8H6FNO3
- Molecular weight
- 183.14
Names & synonyms
80277-50-54-METHYL-3-NITRO-BENZOYL FLUORIDE4-methyl-3-nitrobenzoyl fluorideMFCD13174005SCHEMBL10969379DTXSID80604222DB-286077BETA-ALANINE,N-(2-AMINOETHYL)-N-METHYL-Benzoyl fluoride, 4-methyl-3-nitro-Benzoyl fluoride, 4-methyl-3-nitro- (9CI)
Database identifiers
- CAS
80277-50-5- PubChem CID
- 20257232
- DTXSID
DTXSID80604222
Properties
Computed structural propertiesFilling in
- XLogP
- 2.4
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 226
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…