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Home > Fluorides > 198012-02-1
198012-02-1 | Benzenesulfonamide, 4-methyl-N-[[4-(trifluoromethyl)phenyl]methylene]-
CAS No: 198012-02-1 Catalog No: AG002B7X MDL No:
Product Description
Catalog Number:
AG002B7X
Chemical Name:
Benzenesulfonamide, 4-methyl-N-[[4-(trifluoromethyl)phenyl]methylene]-
CAS Number:
198012-02-1
Molecular Formula:
C15H12F3NO2S
Molecular Weight:
327.3215
IUPAC Name:
4-methyl-N-[[4-(trifluoromethyl)phenyl]methylidene]benzenesulfonamide
InChI:
InChI=1S/C15H12F3NO2S/c1-11-2-8-14(9-3-11)22(20,21)19-10-12-4-6-13(7-5-12)15(16,17)18/h2-10H,1H3
InChI Key:
PORBHQWXDLUOLN-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)N=Cc1ccc(cc1)C(F)(F)F
Properties
Complexity:
480
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.054g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.321g/mol
Monoisotopic Mass:
327.054g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4
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