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N-Acetyl Sulfapyridine

CAT: 0572-TRC-A187910-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-A187910-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
19077-98-6
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2ccccn2
Molecular Formula
C13 H13 N3 O3 S
Molecular Weight
291.33
InChI
InChI=1S/C13H13N3O3S/c1-10(17)15-11-5-7-12(8-6-11)20(18,19)16-13-4-2-3-9-14-13/h2-9H,1H3,(H,14,16)(H,15,17)
Additionnal Information
IUPAC name: N-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Acetylsulfapyridine

N4-Acetylsulfapyridine is a sulfonamide.

CAS Number19077-98-6
PubChem CID58638
IUPAC NameN-[4-(pyridin-2-ylsulfamoyl)phenyl]acetamide
Molecular FormulaC13H13N3O3S
Molecular Weight291.33
XLogP-0.1
Topological Polar Surface Area96.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count20
Formal Charge0
Complexity425
SMILES
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=N2
InChI
InChI=1S/C13H13N3O3S/c1-10(17)15-11-5-7-12(8-6-11)20(18,19)16-13-4-2-3-9-14-13/h2-9H,1H3,(H,14,16)(H,15,17)
InChIKey
CYLYVXPHAQLXFG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Acetylsulfapyridine
CAS: 19077-98-6
CID: 58638
Formula: C13H13N3O3S
MW: 291.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight291.33
XLogP3-0.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass291.06776246
Monoisotopic Mass291.06776246
Topological Polar Surface Area96.5 Ų
Heavy Atom Count20
Formal Charge0
Complexity425
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

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