Home Halogens Benzoyl chloride, 3-chloro-2-fluoro-5-(trifluoromethyl)-

Benzoyl chloride, 3-chloro-2-fluoro-5-(trifluoromethyl)-

CAS No.:
261763-03-5
Catalog Number:
AG002S1Q
Molecular Formula:
C8H2Cl2F4O
Molecular Weight:
261.0005
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Product Description
Catalog Number:
AG002S1Q
Chemical Name:
Benzoyl chloride, 3-chloro-2-fluoro-5-(trifluoromethyl)-
CAS Number:
261763-03-5
Molecular Formula:
C8H2Cl2F4O
Molecular Weight:
261.0005
MDL Number:
MFCD01631511
IUPAC Name:
3-chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride
InChI:
InChI=1S/C8H2Cl2F4O/c9-5-2-3(8(12,13)14)1-4(6(5)11)7(10)15/h1-2H
InChI Key:
WWXKIEVIKMYSCL-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cc(cc(c1F)Cl)C(F)(F)F
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.942g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.997g/mol
Monoisotopic Mass:
259.942g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties