1,1'-Bicyclohexyl, 4-(methoxymethyl)-4'-propyl-
Completing data — refresh the page later to see the latest
Basic information
- CAS
88416-84-6- Standard SMILES
CCCC1CCC(C2CCC(COC)CC2)CC1- InChIKey
XZQPENLZKROMTQ-UHFFFAOYSA-N- Molecular formula
- C17H32O
- Average molar mass
- 252.4 g/mol
- Monoisotopic mass
- 252.24531564
Names & identifiers
- Preferred name
- 1,1'-Bicyclohexyl, 4-(methoxymethyl)-4'-propyl-
- IUPAC
- 1-(methoxymethyl)-4-(4-propylcyclohexyl)cyclohexane
- English name
- trans-4-(Methoxymethyl)-1-(trans-4-propylcyclohexyl)cyclohexane
- Molecular formula
- C17H32O
- Molecular weight
- 252.44
Names & synonyms
1,1'-Bicyclohexyl, 4-(methoxymethyl)-4'-propyl-88416-84-6DTXSID70340506RefChem:212239DTXCID50291587SCHEMBL4803542SCHEMBL5350162SCHEMBL7917321SCHEMBL87364014-(METHOXYMETHYL)-4'-PROPYL-1,1'-BI(CYCLOHEXANE)1,1'-Bicyclohexyl, 4-(methoxymethyl)-4'-propyl-, (trans,trans)-trans-4-(Methoxymethyl)-1-(trans-4-propylcyclohexyl)cyclohexane
Database identifiers
- CAS
88416-84-6- PubChem CID
- 565325
- DTXSID
DTXSID70340506- Nikkaji
- J3.032.824H
Properties
Computed structural propertiesFilling in
- XLogP
- 6.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 210
Physicochemical properties
- Boiling point
- 322.8 · 322.8±10.0 °C(Predicted)
- Density
- 0.887 · 0.887±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…