Basic information
- CAS
2090-15-5- Standard SMILES
CCCCCCC(C1CCCCC1)C1CCCCC1- InChIKey
HPTHOHVOEWQDAX-UHFFFAOYSA-N- Molecular formula
- C19H36
- Average molar mass
- 264.5 g/mol
- Monoisotopic mass
- 264.28170115
Names & identifiers
- Preferred name
- Heptane, 1,1-dicyclohexyl-
- IUPAC
- 1-cyclohexylheptylcyclohexane
- English name
- 1,1-dicyclohexylheptane
- Molecular formula
- C19H36
- Molecular weight
- 264.49
Names & synonyms
Heptane, 1,1-dicyclohexyl-2090-15-5DTXSID40175049Cyclohexane, 1,1'-heptylidenebis-NSC 114850RefChem:145656DTXCID4097540HPTHOHVOEWQDAX-UHFFFAOYSA-N1,1-DICYCLOHEXYLHEPTANE1,1-dicyclohexyl-heptaneNSC114850Heptane,1-dicyclohexyl-
Show more names
SCHEMBL28591512SCHEMBL29214524Cyclohexane,1,1-heptylidenebis-(1-Cyclohexylheptyl)cyclohexane #NSC-1148501,1'-(Heptane-1,1-diyl)dicyclohexaneDS-010657
Database identifiers
- CAS
2090-15-5- PubChem CID
- 16404
- DTXSID
DTXSID40175049- Nikkaji
- J105.032J
Properties
Computed structural properties
- XLogP
- 9.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 190
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- -31.67 °C · -31.67°C
- Boiling point
- 347.72 °C · 347.72°C (estimate)
- Density
- 0.8174 · 0.8174 (estimate)
- refractive index
- 1.4764 · 1.4764 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…