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Sulfamethoxazole Sodium

CAT: 0543-S121-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0543-S121-1GSize:1 g
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CAS Number
4563-84-2
Applications
Microbiology, Plant Biology.
Purity
≥97% (dried basis)
Molecular Formula
C10H10N3NaO3S ∙ Na
Molecular Weight
275.26
Shipping Conditions
≤30°C
Storage Conditions
2-8°C

Chemical Information

Sulfamethoxazole Sodium
CAS Number4563-84-2
PubChem CID15899900
IUPAC Namesodium (4-aminophenyl)sulfonyl-(5-methyl-1,2-oxazol-3-yl)azanide
Molecular FormulaC10H10N3NaO3S
Molecular Weight275.26
Topological Polar Surface Area95.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count18
Formal Charge0
Complexity352
SMILES
CC1=CC(=NO1)[N-]S(=O)(=O)C2=CC=C(C=C2)N.[Na+]
InChI
InChI=1S/C10H10N3O3S.Na/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9;/h2-6H,11H2,1H3;/q-1;+1
InChIKey
LARLNXOUTTUXPN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Sulfamethoxazole Sodium
CAS: 4563-84-2
CID: 15899900
Formula: C10H10N3NaO3S
MW: 275.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight275.26
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass275.03405664
Monoisotopic Mass275.03405664
Topological Polar Surface Area95.6 Ų
Heavy Atom Count18
Formal Charge0
Complexity352
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes