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197384-98-8 | Sulfur, [4-(chlorocarbonyl)phenyl]pentafluoro-, (OC-6-21)-
CAS No: 197384-98-8 Catalog No: AG002AS6 MDL No:MFCD03788523
Product Description
Catalog Number:
AG002AS6
Chemical Name:
Sulfur, [4-(chlorocarbonyl)phenyl]pentafluoro-, (OC-6-21)-
CAS Number:
197384-98-8
Molecular Formula:
C7H4ClF5OS
Molecular Weight:
266.6161
MDL Number:
MFCD03788523
IUPAC Name:
4-(pentafluoro-λ6-sulfanyl)benzoyl chloride
InChI:
InChI=1S/C7H4ClF5OS/c8-7(14)5-1-3-6(4-2-5)15(9,10,11,12)13/h1-4H
InChI Key:
NNFDYUZNKYWPGP-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc(cc1)S(F)(F)(F)(F)F
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.959g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.61g/mol
Monoisotopic Mass:
265.959g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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