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Home > Fluorides > 1027345-07-8
1027345-07-8 | Benzenesulfonyl chloride, 4-fluoro-3-[(trifluoromethyl)sulfonyl]-
CAS No: 1027345-07-8 Catalog No: AG00088Q MDL No:MFCD16883063
Product Description
Catalog Number:
AG00088Q
Chemical Name:
Benzenesulfonyl chloride, 4-fluoro-3-[(trifluoromethyl)sulfonyl]-
CAS Number:
1027345-07-8
Molecular Formula:
C7H3ClF4O4S2
Molecular Weight:
326.6729
MDL Number:
MFCD16883063
IUPAC Name:
4-fluoro-3-(trifluoromethylsulfonyl)benzenesulfonyl chloride
InChI:
InChI=1S/C7H3ClF4O4S2/c8-18(15,16)4-1-2-5(9)6(3-4)17(13,14)7(10,11)12/h1-3H
InChI Key:
SYZOKHJRIIDLOQ-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)Cl
Properties
Complexity:
501
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.91g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.661g/mol
Monoisotopic Mass:
325.91g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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