Octadec-9-en-1-yl hydrogen sulfate
Basic information
- CAS
16198-72-4- Standard SMILES
CCCCCCCCC=CCCCCCCCCOS(=O)(=O)O- InChIKey
ZUBJEHHGZYTRPH-UHFFFAOYSA-N- Molecular formula
- C18H36O4S
- Average molar mass
- 348.5 g/mol
- Monoisotopic mass
- 348.2334308
Names & identifiers
- Preferred name
- Octadec-9-en-1-yl hydrogen sulfate
- IUPAC
- octadec-9-enyl hydrogen sulfate
Names & synonyms
Octadec-9-en-1-yl hydrogen sulfate16198-72-4SCHEMBL29167DTXSID308596849-Octadecen-1-ol, 1-(hydrogen sulfate)
Database identifiers
- CAS
16198-72-4- PubChem CID
- 15802
- DTXSID
DTXSID30859684
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 72 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 17
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 358
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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