Basic information
- CAS
61556-93-2- Standard SMILES
CCCS(=O)(=O)OCCCCCC[NH2+]CCOS(=O)(=O)CCC.[Cl-]- InChIKey
HYPVPPIVXBHYDO-UHFFFAOYSA-N- Molecular formula
- C14H32ClNO6S2
- Average molar mass
- 410 g/mol
- Monoisotopic mass
- 409.1359578
Names & identifiers
- Preferred name
- 1-Hexanol, 6-((2-hydroxyethyl)amino)-, dipropanesulfonate (ester), hydrochloride
- IUPAC
- 2-propylsulfonyloxyethyl(6-propylsulfonyloxyhexyl)azanium chloride
Names & synonyms
6-((2-Hydroxyethyl)amino)-1-hexanol dipropanesulfonate hydrochloride61556-93-21-HEXANOL, 6-((2-HYDROXYETHYL)AMINO)-, DIPROPANESULFONATE (ester), HYDROCHLORIDERefChem:230724
Database identifiers
- CAS
61556-93-2- PubChem CID
- 43692
Properties
Computed structural properties
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 16
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 464
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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