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Home > Fluorides > 886499-99-6
886499-99-6 | 3-Fluoro-5-(trifluoromethyl);benzene-1-sulfonyl chloride
CAS No: 886499-99-6 Catalog No: AG003JGK MDL No:MFCD06660226
Product Description
Catalog Number:
AG003JGK
Chemical Name:
3-Fluoro-5-(trifluoromethyl);benzene-1-sulfonyl chloride
CAS Number:
886499-99-6
Molecular Formula:
C7H3ClF4O2S
Molecular Weight:
262.6091
MDL Number:
MFCD06660226
IUPAC Name:
3-fluoro-5-(trifluoromethyl)benzenesulfonyl chloride
InChI:
InChI=1S/C7H3ClF4O2S/c8-15(13,14)6-2-4(7(10,11)12)1-5(9)3-6/h1-3H
InChI Key:
LANWEGQCPRKLAI-UHFFFAOYSA-N
SMILES:
Fc1cc(cc(c1)S(=O)(=O)Cl)C(F)(F)F
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.948g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.603g/mol
Monoisotopic Mass:
261.948g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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