Diisobutylnaphthalene-2-sulphonic acid

Base Information

• Chemical Name: Diisobutylnaphthalene-2-sulphonic acid
• CAS No.: 94247-75-3
• Molecular Formula: C18H24 O3 S
• Molecular Weight: 320.44636
• European Community (EC) Number: 304-245-7
• UNII: 6Z9PEP679S
• DSSTox Substance ID: DTXSID90241268
• Wikidata: Q83124702
• Mol file: 94247-75-3.mol

Synonyms:Diisobutylnaphthalene-2-sulphonic acid;94247-75-3;6Z9PEP679S;DIISOBUTYLNAPHTHALENE-2-SULFONIC ACID;EINECS 304-245-7;1,3-Bis(2-methylpropyl)-2-naphthalenesulfonic acid;2-Naphthalenesulfonic acid, 1,3-bis(2-methylpropyl)-;UNII-6Z9PEP679S;SCHEMBL6555708;DTXSID90241268;958820-46-7

Chemical Property of Diisobutylnaphthalene-2-sulphonic acid

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 62.75000
• Density: 1.149g/cm³
• LogP: 5.56430
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 320.14461580
• Heavy Atom Count: 22
• Complexity: 449

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CC1=CC2=CC=CC=C2C(=C1S(=O)(=O)O)CC(C)C