3-nitrobenzenesulfonic Acid Hydrate

Base Information

• Chemical Name: 3-nitrobenzenesulfonic Acid Hydrate
• CAS No.: 79326-96-8
• Molecular Formula: C6H7NO6S
• Molecular Weight: 221.19
• Hs Code.: 29049095
• Mol file: 79326-96-8.mol

Synonyms:3-nitrobenzenesulfonic Acid Hydrate;79326-96-8;3-NITROBENZENESULFONIC ACID MONOHYDRATE;C6H7NO6S;SCHEMBL8747065;3-NitrobenzenesulfonicAcidHydrate;3-nitrobenzenesulfonic acid;hydrate;MFCD00151046;AKOS025290410;3-nitrobenzene-1-sulfonic acid hydrate;AS-63999;CS-0156869;D82946;A864877

Chemical Property of 3-nitrobenzenesulfonic Acid Hydrate

Chemical Property:

• Melting Point: 90-95 °C
• PSA: 117.80000
• LogP: 2.38120
• Storage Temp.: 0-6°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 220.99940812
• Heavy Atom Count: 14
• Complexity: 287

Purity/Quality:

99%, ^*data from raw suppliers

3-NITROBENZENESULFONIC ACID HYDRATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• 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)[N+](=O)[O-].O

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