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Home > Fluorides > 113845-12-8
113845-12-8 | Benzenesulfonamide, 2,3,4,5,6-pentafluoro-N-propyl-
CAS No: 113845-12-8 Catalog No: AG0009VU MDL No:
Product Description
Catalog Number:
AG0009VU
Chemical Name:
Benzenesulfonamide, 2,3,4,5,6-pentafluoro-N-propyl-
CAS Number:
113845-12-8
Molecular Formula:
C9H8F5NO2S
Molecular Weight:
289.2223
IUPAC Name:
2,3,4,5,6-pentafluoro-N-propylbenzenesulfonamide
InChI:
InChI=1S/C9H8F5NO2S/c1-2-3-15-18(16,17)9-7(13)5(11)4(10)6(12)8(9)14/h15H,2-3H2,1H3
InChI Key:
AHSZIVOHDRMIBO-UHFFFAOYSA-N
SMILES:
CCCNS(=O)(=O)c1c(F)c(F)c(c(c1F)F)F
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.02g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.22g/mol
Monoisotopic Mass:
289.02g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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