4-amino-N-argentio-N-(pyrimidin-2-yl)benzene-1-sulfonamide

• ChemBase ID: 51103
• Molecular Formular: C10H9AgN4O2S
• Molecular Mass: 357.13726
• Monoisotopic Mass: 355.94971855
• SMILES: S(=O)(=O)(N(c1ncccn1)[Ag])c1ccc(N)cc1
• Canonical SMILES: [Ag]N(S(=O)(=O)c1ccc(cc1)N)c1ncccn1
• InChI: InChI=1S/C10H9N4O2S.Ag/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10;/h1-7H,11H2;/q-1;+1
• InChIKey: UEJSSZHHYBHCEL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-amino-N-argentio-N-(pyrimidin-2-yl)benzene-1-sulfonamide
• IUPAC Traditional name: 4-amino-N-argentio-N-(pyrimidin-2-yl)benzenesulfonamide
• Synonyms: Silver sulfadiazine; Sulfadiazine silver; Silver(I) sulfadiazine; 磺胺嘧啶银; 磺胺嘧啶银(I)

Database IDs

• CAS Number: 22199-08-2
• EC Number: 244-834-5
• MDL Number: MFCD00072101
• PubChem SID: 24871745; 162055866
• PubChem CID: 452254

CALCULATED PROPERTIES

• H Acceptors: 5
• H Donor: 1
• LogD (pH = 5.5): 0.57776153
• LogD (pH = 7.4): 0.57789826
• Log P: 0.5779
• Molar Refractivity: 63.4009 cm^3
• Polarizability: 28.944445 Å^3
• Polar Surface Area: 89.18 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: powder
• Melting Point: 285 °C (dec.)(lit.)

Safety Information

• Storage Warning: IRRITANT
• RTECS: WP1950000
• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 2
• Risk Statements: 36/37/38
• Safety Statements: 26
• TSCA Listed: false
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338

Product Information

• Purity: 98%
• Empirical Formula (Hill Notation): C10H9AgN4O2S

DETAILS

Sigma Aldrich - 481181

Frequently Asked Questions
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Packaging
5, 25 g in glass bottle