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Sulfamethoxazole EP Impurity C

CAT: 1596-AR-O23345-01Size: 50 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-O23345-01Size:50 Units
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CAS Number
1072-67-9
Synonyms
5-Methyl-3-isoxazolamine; 5-Methyl-1,2-oxazol-3-amine; 5-Methyl-3-aminoisoxazole; 5-Methyl-3-isoxazolamine; 5-Methyl-3-isoxazolylamine;3-Amino-5-methylisoxazole
Molecular Formula
C4H6N2O
Molecular Weight
98.10
API Name
Sulfamethoxazole

Chemical Information

3-Amino-5-methylisoxazole
CAS Number1072-67-9
PubChem CID66172
IUPAC Name5-methyl-1,2-oxazol-3-amine
Molecular FormulaC4H6N2O
Molecular Weight98.10
XLogP0.1
Topological Polar Surface Area52.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count7
Formal Charge0
Complexity66
SMILES
CC1=CC(=NO1)N
InChI
InChI=1S/C4H6N2O/c1-3-2-4(5)6-7-3/h2H,1H3,(H2,5,6)
InChIKey
FKPXGNGUVSHWQQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Amino-5-methylisoxazole
CAS: 1072-67-9
CID: 66172
Formula: C4H6N2O
MW: 98.10
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight98.10
XLogP30.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass98.048012819
Monoisotopic Mass98.048012819
Topological Polar Surface Area52.1 Ų
Heavy Atom Count7
Formal Charge0
Complexity66.7
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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RM-S210108-01Sulfamethoxazole Impurity 8
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