Basic information
- CAS
68527-63-9- Standard SMILES
CCCCCCCCC=CCCCCCCCC1=NCCN1CCO.CCOS(=O)(=O)OCC- InChIKey
VZRKETAUDBGCTG-UHFFFAOYSA-N- Molecular formula
- C26H52N2O5S
- Average molar mass
- 504.8 g/mol
- Monoisotopic mass
- 504.35969394
Names & identifiers
- Preferred name
- Diethyl sulfate--2-[2-(heptadec-8-en-1-yl)-4,5-dihydro-1H-imidazol-1-yl]ethan-1-ol (1/1)
- IUPAC
- diethyl sulfate;2-(2-heptadec-8-enyl-4,5-dihydroimidazol-1-yl)ethanol
Names & synonyms
DTXSID7071606VZRKETAUDBGCTG-UHFFFAOYSA-NNS00091596Diethyl sulfate--2-[2-(heptadec-8-en-1-yl)-4,5-dihydro-1H-imidazol-1-yl]ethan-1-ol (1/1)
Database identifiers
- CAS
68527-63-9- PubChem CID
- 110458
- DTXSID
DTXSID7071606
Properties
Computed structural properties
- Topological polar surface area
- 96.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 21
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 482
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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