Basic information
- Standard SMILES
CCCCCC.CCCCCCCCCCS- InChIKey
PAKDCIUNNSYJSI-UHFFFAOYSA-N- Molecular formula
- C16H36S
- Average molar mass
- 260.5 g/mol
- Monoisotopic mass
- 260.25377232
Names & identifiers
- Preferred name
- Decanethiol n-hexane
- IUPAC
- decane-1-thiol;hexane
Names & synonyms
decanethiol n-hexanePAKDCIUNNSYJSI-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 86757609
Properties
Computed structural properties
- Topological polar surface area
- 1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 11
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 73
Related reactions
1 records
Compound notes
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