Benzenesulfonic acid, dodecyl-, compd. with ethanamine (1:1)
Basic information
- CAS
35465-66-8- Standard SMILES
CCCCCCCCCCCCc1ccccc1S(=O)(=O)O.CCN- InChIKey
ZKEZLMBLGVVVBT-UHFFFAOYSA-N- Molecular formula
- C20H37NO3S
- Average molar mass
- 371.6 g/mol
- Monoisotopic mass
- 371.24941522
Names & identifiers
- Preferred name
- Benzenesulfonic acid, dodecyl-, compd. with ethanamine (1:1)
- IUPAC
- 2-dodecylbenzenesulfonic acid;ethanamine
Names & synonyms
Ethylamine dodecylbenzenesulfonate35465-66-8EINECS 252-579-6DTXSID0067923RefChem:118051DTXCID9039028Dodecylbenzenesulphonic acid, compound with ethylamine (1:1)2-Dodecylbenzene-1-sulfonic acid--ethanamine (1/1)
Database identifiers
- CAS
35465-66-8- PubChem CID
- 169698
- DTXSID
DTXSID0067923- EC Number
- 252-579-6
Properties
Computed structural properties
- Topological polar surface area
- 88.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 362
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenesulfonic acid, dodecyl-, compd. with ethanamine (1:1): INACTIVE
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Related reactions
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Compound notes
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