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32333-53-2 | 4-Chloro-3-(trifluoromethyl)benzene-1-sulfonyl chloride
CAS No: 32333-53-2 Catalog No: AG0033ZC MDL No:MFCD00024882
Product Description
Catalog Number:
AG0033ZC
Chemical Name:
4-Chloro-3-(trifluoromethyl)benzene-1-sulfonyl chloride
CAS Number:
32333-53-2
Molecular Formula:
C7H3Cl2F3O2S
Molecular Weight:
279.0637
MDL Number:
MFCD00024882
IUPAC Name:
4-chloro-3-(trifluoromethyl)benzenesulfonyl chloride
InChI:
InChI=1S/C7H3Cl2F3O2S/c8-6-2-1-4(15(9,13)14)3-5(6)7(10,11)12/h1-3H
InChI Key:
SSULGNXFUGLULI-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1C(F)(F)F)S(=O)(=O)Cl
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.918g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.054g/mol
Monoisotopic Mass:
277.918g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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