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FH535 5mg

CAT: 0628-A13795-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0628-A13795-5Size:5 mg
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CAS Number
108409-83-2

Chemical Information

FH535

2,5-dichloro-N-(2-methyl-4-nitrophenyl)benzenesulfonamide is a sulfonamide.

CAS Number108409-83-2
PubChem CID3463933
IUPAC Name2,5-dichloro-N-(2-methyl-4-nitrophenyl)benzenesulfonamide
Molecular FormulaC13H10Cl2N2O4S
Molecular Weight361.2
XLogP3.9
Topological Polar Surface Area100
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity505
SMILES
CC1=C(C=CC(=C1)[N+](=O)[O-])NS(=O)(=O)C2=C(C=CC(=C2)Cl)Cl
InChI
InChI=1S/C13H10Cl2N2O4S/c1-8-6-10(17(18)19)3-5-12(8)16-22(20,21)13-7-9(14)2-4-11(13)15/h2-7,16H,1H3
InChIKey
AXNUEXXEQGQWPA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of FH535
CAS: 108409-83-2
CID: 3463933
Formula: C13H10Cl2N2O4S
MW: 361.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight361.2
XLogP33.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass359.9738334
Monoisotopic Mass359.9738334
Topological Polar Surface Area100 Ų
Heavy Atom Count22
Formal Charge0
Complexity505
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes