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Sulfadimethoxine EP Impurity C

CAT: 1299-RM-S212603-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-S212603-01Size:10 mg
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CAS Number
121-62-0
Synonyms
4-acetamidobenzenesulfonic acid
Molecular Formula
C8H9NO4S
Molecular Weight
215.23
Target Alternative Name
Sulfadimethoxine
Product Name Synonym
4-acetamidobenzenesulfonic acid

Chemical Information

N-Acetylsulfanilic acid
CAS Number121-62-0
PubChem CID8483
IUPAC Name4-acetamidobenzenesulfonic acid
Molecular FormulaC8H9NO4S
Molecular Weight215.23
XLogP0.1
Topological Polar Surface Area91.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity298
SMILES
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)O
InChI
InChI=1S/C8H9NO4S/c1-6(10)9-7-2-4-8(5-3-7)14(11,12)13/h2-5H,1H3,(H,9,10)(H,11,12,13)
InChIKey
ZQPVMSLLKQTRMG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Acetylsulfanilic acid
CAS: 121-62-0
CID: 8483
Formula: C8H9NO4S
MW: 215.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight215.23
XLogP30.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass215.02522894
Monoisotopic Mass215.02522894
Topological Polar Surface Area91.9 Ų
Heavy Atom Count14
Formal Charge0
Complexity298
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