Sulfaquinoxaline - ≥98% , CAS No.59-40-5

CAS: 59-40-5 Cat. No.: S1523158 Molecular Weight: 300.34 Beilstein Registry Number: 290026 EC Number: 200-423-2 PubChem CID: 5338

GRADE & PURITY ≥98%

Storage

Room temperature

Shipped In

Normal

Specifications

Specifications & Purity

≥98%

Storage

Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Canonical Smiles: C1=CC=C2C(=C1)N=CC(=N2)NS(=O)(=O)C3=CC=C(C=C3)N
• IUPAC Name: 4-amino-N-quinoxalin-2-ylbenzenesulfonamide
• InChIKey: NHZLNPMOSADWGC-UHFFFAOYSA-N
• INCHI: 1S/C14H12N4O2S/c15-10-5-7-11(8-6-10)21(19,20)18-14-9-16-12-3-1-2-4-13(12)17-14/h1-9H,15H2,(H,17,18)
• Isomeric SMILES: C1=CC=C2C(=C1)N=CC(=N2)NS(=O)(=O)C3=CC=C(C=C3)N
• PubChem CID: 5338
• Molecular Weight: 300.34
• Beilstein: 290026

Chemical and Physical Properties

• Molecular Weight: 300.340 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 300.068 Da
• Monoisotopic Mass: 300.068 Da
• Topological Polar Surface Area: 106.000 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 442.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

References

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