Sodium 3-sulfonatobenzoate hydrate

Base Information

• Chemical Name: Sodium 3-sulfonatobenzoate hydrate
• CAS No.: 14995-40-5
• Molecular Formula: C₇H₄O₅S*2Na
• Molecular Weight: 246.151
• Hs Code.: 2916399090
• European Community (EC) Number: 239-081-4
• Mol file: 14995-40-5.mol

Synonyms:14995-40-5;3-Sulfobenzoic acid disodium salt monohydrate;Sodium 3-sulfonatobenzoate hydrate;disodium;3-sulfonatobenzoate;hydrate;C7H6O5S.2Na;C7-H6-O5-S.2Na;Sodium3-sulfonatobenzoatehydrate

Chemical Property of Sodium 3-sulfonatobenzoate hydrate

Chemical Property:

• Boiling Point: °Cat760mmHg
• PKA: pK2:3.78 (25°C)
• Flash Point: °C
• PSA: 114.94000
• Density: 1.62g/cm³
• LogP: -0.02930
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 263.96804764
• Heavy Atom Count: 16
• Complexity: 270

Purity/Quality:

98%Min ^*data from raw suppliers

3-SULFOBENZOIC ACID DISODIUM SALT MONOHYDRATE 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 37/39-26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)S(=O)(=O)[O-])C(=O)[O-].O.[Na+].[Na+]