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101513-78-4 | Benzoyl chloride, 3-chloro-2,4,5-trifluoro-
CAS No: 101513-78-4 Catalog No: AG0004P4 MDL No:MFCD04039245
Product Description
Catalog Number:
AG0004P4
Chemical Name:
Benzoyl chloride, 3-chloro-2,4,5-trifluoro-
CAS Number:
101513-78-4
Molecular Formula:
C7HCl2F3O
Molecular Weight:
228.9834
MDL Number:
MFCD04039245
IUPAC Name:
3-chloro-2,4,5-trifluorobenzoyl chloride
InChI:
InChI=1S/C7HCl2F3O/c8-4-5(11)2(7(9)13)1-3(10)6(4)12/h1H
InChI Key:
IEDMMCZBIKXEJP-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cc(F)c(c(c1F)Cl)F
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.936g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.979g/mol
Monoisotopic Mass:
227.936g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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