Basic information
- CAS
100544-80-7- Standard SMILES
OC1CCC(CC2CCCCC2)CC1- InChIKey
QYZFQZJJSMHXOK-UHFFFAOYSA-N- Molecular formula
- C13H24O
- Average molar mass
- 196.33 g/mol
- Monoisotopic mass
- 196.18271539
Names & identifiers
- Preferred name
- Cyclohexanol, 4-(cyclohexylmethyl)-
- IUPAC
- 4-(cyclohexylmethyl)cyclohexan-1-ol
Names & synonyms
Cyclohexanol, 4-(cyclohexylmethyl)-4-CyclohexylmethylcyclohexanolBRN 3233223100544-80-7DTXSID101433764-06-00-00322 (Beilstein Handbook Reference)RefChem:335522DTXCID90658674-(cyclohexylmethyl)cyclohexanol4-(cyclohexylmethyl)cyclohexan-1-olNSC67880NCIOpen2_000805
Show more names
SCHEMBL22875519NSC-67880DB-152885
Database identifiers
- CAS
100544-80-7- PubChem CID
- 249489
- DTXSID
DTXSID10143376- Nikkaji
- J75.440D
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 153
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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