C1=CC(=C(C=C1C(F)(F)F)F)C(=O)Cl
CAS: 126917-10-0
Name: 2-fluoro-4-(trifluoromethyl)benzoyl chloride
SMILES: C1=CC(=C(C=C1C(F)(F)F)F)C(=O)Cl

Molecular Processing

Molecular formula
C8H3ClF4O
Molecular weight
226.56
Exact mass
225.9809
XLogP
3.22
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
41.59

Supplementary Information

InChIKey: OOAHPLWBUUTFMV-UHFFFAOYSA-N
Synonyms
2-Fluoro-4-(trifluoromethyl)benzoyl chloride126917-10-0DTXSID80155325RefChem:87069DTXCID9077816624-765-0OOAHPLWBUUTFMV-UHFFFAOYSA-NBenzoyl chloride, 2-fluoro-4-(trifluoromethyl)-MFCD000611552-fluoro-4-trifluoromethylbenzoyl chloride4-trifluoromethyl-2-fluorobenzoyl chloride2-fluoro-4-(trifluoromethyl)benzoylchloride2-Fluoro-4-trifluoromethyl-benzoyl chlorideSCHEMBL4963242-fluoro-4-trifluoromethyl-1-benzenecarbonyl chlorideSBB097012AKOS015853265AS-407452-fluoro-4-trifluoromethyl-benzoylchloride2-fluoro-4-trifluoromethyl benzoyl chloride4-trifluoromethyl-2-fluoro-benzoyl chlorideDB-0418472-fluoro -4-(trifluoromethyl)benzoyl chlorideF0064032-Fluoro-4-(trifluoromethyl)benzoyl chloride, 98%2-Fluoro-4-(trifluoromethyl)-1-benzenecarbonyl chloride2-Fluoro-4-(trifluoromethyl)benzoyl chloride 97%;2-fluoro-4-trifluoromethyl-1-benzenecarbonyl chloride
View source →
Involved in 46 reactions→

Extended Search

Substructure Search→Similarity Search→