Basic information
- CAS
15416-78-1- Standard SMILES
CCCCCCCCCCCCCCCCCOS(=O)(=O)O- InChIKey
KGIBGHABTNQVJX-UHFFFAOYSA-N- Molecular formula
- C17H36O4S
- Average molar mass
- 336.5 g/mol
- Monoisotopic mass
- 336.2334308
Overview
Heptadecyl sulfate has been reported in Colossendeis angusta and Aplidium turbinatum with data available.
Names & identifiers
- Preferred name
- Heptadecyl sulfate
- IUPAC
- heptadecyl hydrogen sulfate
Names & synonyms
heptadecyl sulfateheptadecyl hydrogen sulfateSCHEMBL771184CHEMBL1207937DTXSID9086089215416-78-1NS00095003
Database identifiers
- CAS
15416-78-1- PubChem CID
- 82166
- DTXSID
DTXSID90860892- ChEMBL
CHEMBL1207937- Nikkaji
- J140.475J
Properties
Computed structural properties
- XLogP
- 7.5
- Topological polar surface area
- 72 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 17
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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