CID 32673488
PubChem CID
32673488
Structure
Molecular Formula
Status
Non-live
Molecular Weight
334.72 g/mol
Dates
- Create:2009-05-29
Chemical Structure Depiction
(2-chloro-4-methylphenyl)sulfonyl-(2,3,4-trifluorophenyl)azanide
InChI=1S/C13H8ClF3NO2S/c1-7-2-5-11(8(14)6-7)21(19,20)18-10-4-3-9(15)12(16)13(10)17/h2-6H,1H3/q-1
UFNXZABHZYHEQW-UHFFFAOYSA-N
CC1=CC(=C(C=C1)S(=O)(=O)[N-]C2=C(C(=C(C=C2)F)F)F)Cl
C13H8ClF3NO2S-
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
334.72 g/mol
Property Name
XLogP3-AA
Property Value
3.7
Property Name
Hydrogen Bond Donor Count
Property Value
0
Property Name
Hydrogen Bond Acceptor Count
Property Value
6
Property Name
Rotatable Bond Count
Property Value
3
Property Name
Exact Mass
Property Value
333.9916369 g/mol
Property Name
Monoisotopic Mass
Property Value
333.9916369 g/mol
Property Name
Topological Polar Surface Area
Property Value
43.5 A^2
Property Name
Heavy Atom Count
Property Value
21
Property Name
Formal Charge
Property Value
-1
Property Name
Complexity
Property Value
459
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
Old substance
Old substance
CONTENTS