C1=CC(=CC=C1C(=O)Cl)C(F)(F)F
CAS: 329-15-7
Nom: 4-(trifluoromethyl)benzoyl chloride
SMILES: C1=CC(=CC=C1C(=O)Cl)C(F)(F)F

Molecular Processing

Molecular formula
C8H4ClF3O
Molecular weight
208.57
Exact mass
207.9903
XLogP
3.08
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
41.63

Supplementary Information

InChIKey: OXZYBOLWRXENKT-UHFFFAOYSA-N
Synonymes
4-(Trifluoromethyl)benzoyl chloride329-15-7p-(Trifluoromethyl)benzoyl chlorideBenzoyl chloride, 4-(trifluoromethyl)-p-Trifluoromethylbenzoyl chloride4-trifluoromethylbenzoyl chlorideEINECS 206-342-9NSC 88292DTXSID6059817OXZYBOLWRXENKT-UHFFFAOYSA-RefChem:97589DTXCID2038603InChI=1/C8H4ClF3O/c9-7(13)5-1-3-6(4-2-5)8(10,11)12/h1-4HOXZYBOLWRXENKT-UHFFFAOYSA-N4-(Trifluoromethyl)benzoylchloridealpha,alpha,alpha-Trifluoro-p-toluoyl chlorideMFCD00000694p-Trifluoromethyl benzoic acid chloride4-Trifluoromethyl-benzoyl chlorideNSC-882924-(Trifluoromethtyl)benzoyl chlorideZHG77DS3BTp-Toluoyl chloride, alpha,alpha,alpha-trifluoro-NCIOpen2_005266SCHEMBL681774-trifluoromethylbenzoylchloride4-trifluromethylbenzoyl chloridep-trifluoromethyl benzoylchloride4-trifluoromethyl benzoylchloride4-trifluoromethyl-benzoylchloride
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Recherche Etendue

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