1,3,5-Tricyclohexylcyclohexane
Basic information
- CAS
6297-08-1- Standard SMILES
C1CCC(C2CC(C3CCCCC3)CC(C3CCCCC3)C2)CC1- InChIKey
BHVSYYXNHKDZHH-UHFFFAOYSA-N- Molecular formula
- C24H42
- Average molar mass
- 330.6 g/mol
- Monoisotopic mass
- 330.32865134
Names & identifiers
- Preferred name
- 1,3,5-Tricyclohexylcyclohexane
- IUPAC
- 1,3,5-tricyclohexylcyclohexane
- English name
- 1,3,5-tricyclohexylcyclohexane
- Molecular formula
- C24H42
- Molecular weight
- 330.59
Names & synonyms
1,3,5-tricyclohexylcyclohexane6297-08-1NSC17530SCHEMBL31498325DTXSID70280594NSC-175302~5~-Cyclohexyl-1~1~,2~1~:2~3~,3~1~-tercyclohexane1,1':3',1''-Tercyclohexane, 5'-cyclohexyl- (9CI)
Database identifiers
- CAS
6297-08-1- PubChem CID
- 226772
- DTXSID
DTXSID70280594- Nikkaji
- J1.751.070C
Properties
Computed structural properties
- XLogP
- 10.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 285
Physicochemical properties
- Melting point
- 159 · 159-160 °C
- Boiling point
- 228 · 228-228.5 °C(Press: 3-5 Torr)
- Density
- 0.953 · 0.953±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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