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Home > Fluorides > 116827-38-4
116827-38-4 | Benzenemethanesulfonyl chloride, 2-(trifluoromethoxy)-
CAS No: 116827-38-4 Catalog No: AG000D99 MDL No:MFCD09749658
Product Description
Catalog Number:
AG000D99
Chemical Name:
Benzenemethanesulfonyl chloride, 2-(trifluoromethoxy)-
CAS Number:
116827-38-4
Molecular Formula:
C8H6ClF3O3S
Molecular Weight:
274.6446
MDL Number:
MFCD09749658
IUPAC Name:
[2-(trifluoromethoxy)phenyl]methanesulfonyl chloride
InChI:
InChI=1S/C8H6ClF3O3S/c9-16(13,14)5-6-3-1-2-4-7(6)15-8(10,11)12/h1-4H,5H2
InChI Key:
BICRWGINZIMNCC-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)Cc1ccccc1OC(F)(F)F
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.968g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.638g/mol
Monoisotopic Mass:
273.968g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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