5-Sulfosalicylic acid hydrate

Base Information

• Chemical Name: 5-Sulfosalicylic acid hydrate
• CAS No.: 304851-84-1
• Molecular Formula: C7H6 O6 S . H2 O
• Molecular Weight: 236.202
• Hs Code.: 2918290000
• European Community (EC) Number: 684-226-0
• DSSTox Substance ID: DTXSID80349828
• ChEMBL ID: CHEMBL1308853
• Mol file: 304851-84-1.mol

Synonyms:5-Sulfosalicylic acid hydrate;304851-84-1;2-hydroxy-5-sulfobenzoic acid hydrate;2-hydroxy-5-sulfobenzoic acid;hydrate;Benzoic acid, 2-hydroxy-5-sulfo-, hydrate (1:1);MLS000084589;SCHEMBL818713;CHEMBL1308853;DTXSID80349828;HMS2289M10;5-Sulfosalicylic acid hydrate, 95%;AS-67604;SMR000046135;5-SULFOSALICYLIC ACID HYDRATE 95;D95905;J-017979

Chemical Property of 5-Sulfosalicylic acid hydrate

Chemical Property:

• Vapor Pressure: 2.12E-16mmHg at 25°C
• Boiling Point: 623.3°C at 760 mmHg
• Flash Point: 330.8°C
• PSA: 129.51000
• LogP: 1.35360
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 235.99907376
• Heavy Atom Count: 15
• Complexity: 316

Purity/Quality:

98%,99%, ^*data from raw suppliers

5-Sulfosalicylic acid hydrate 95% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O.O
• Uses: 5-Sulfosalicylic acid hydrate can be used in the synthesis of hydrated complexes with benzotriazole, N, N′-dimethylpiperazine and N-methylpiperazine for the study of hydrogen bonding in supramolecular crystal structure.