2,3-Diethylcyclohexane-1-thiol
Basic information
- CAS
827024-46-4- Standard SMILES
CCC1CCCC(S)C1CC- InChIKey
KXCGPWBOGYEXGV-UHFFFAOYSA-N- Molecular formula
- C10H20S
- Average molar mass
- 172.33 g/mol
- Monoisotopic mass
- 172.12857181
Names & identifiers
- Preferred name
- 2,3-Diethylcyclohexane-1-thiol
- IUPAC
- 2,3-diethylcyclohexane-1-thiol
Names & synonyms
2,3-Diethylcyclohexane-1-thiol827024-46-4DTXSID30837164
Database identifiers
- CAS
827024-46-4- PubChem CID
- 71417834
- DTXSID
DTXSID30837164
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 111
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Related reactions
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Compound notes
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