Basic information
- CAS
143077-71-8- Standard SMILES
CCC(C)c1cc(S(=O)(=O)O)c2ccccc2c1- InChIKey
LNUMHIKQPHWQFR-UHFFFAOYSA-N- Molecular formula
- C14H16O3S
- Average molar mass
- 264.34 g/mol
- Monoisotopic mass
- 264.08201554
Names & identifiers
- Preferred name
- Naphthalenesulfonic acid, (1-methylpropyl)-
- IUPAC
- 3-butan-2-ylnaphthalene-1-sulfonic acid
Names & synonyms
sec-Butylnaphthalenesulfonic acid143077-71-8(1-Methylpropyl)naphthalenesulfonic acidNaphthalenesulfonic acid, (1-methylpropyl)-RefChem:831879DTXSID20931741LNUMHIKQPHWQFR-UHFFFAOYSA-N3-(butan-2-yl)naphthalene-1-sulfonic acid
Database identifiers
- CAS
143077-71-8- PubChem CID
- 86245
- DTXSID
DTXSID20931741
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 371
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationNaphthalenesulfonic acid, (1-methylpropyl)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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