3-[5,5,6-Trimethylbicyclo[2.2.1]hept-2-yl]cyclohexan-1-ol

Base Information

• Chemical Name: 3-[5,5,6-Trimethylbicyclo[2.2.1]hept-2-yl]cyclohexan-1-ol
• CAS No.: 3407-42-9
• Molecular Formula: C16H28O
• Molecular Weight: 236.398
• Hs Code.: 29061990
• European Community (EC) Number: 222-294-1
• DSSTox Substance ID: DTXSID5044817
• Nikkaji Number: J52.225B
• Wikipedia: Isobornyl_cyclohexanol
• Wikidata: Q4407886
• RXCUI: 2397710
• Metabolomics Workbench ID: 45152
• ChEMBL ID: CHEMBL3182308
• Mol file: 3407-42-9.mol

Synonyms:3407-42-9;Sandenol;Isobornyl cyclohexanol;3-(5,5,6-Trimethyl-2-norbornyl)cyclohexanol;UNII-34UP96K73Z;3-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)cyclohexanol;DTXSID5044817;Cyclohexanol, 3-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)-;3-(5,5,6-trimethyl-2-bicyclo[2.2.1]heptanyl)cyclohexan-1-ol;EINECS 222-294-1;3-(5,5,6-Trimethylbicyclo(2.2.1)hept-2-yl)cyclohexanol;3-(5,6,6-Trimethylbicyclo[2.2.1]hept-1-yl)cyclohexanol;3-[5,5,6-Trimethylbicyclo[2.2.1]hept-2-yl]cyclohexan-1-ol;EC 222-294-1;Cyclohexanol, (5,5,6-trimethyl-2-norbornyl)-;3-(5,5,6-Trimethylbicyclo[2.2.1]heptan-2-yl)cyclohexanol;Cyclohexanol, 3-(5,5,6-trimethylbicyclo(2.2.1)hept-2-yl)-;3-Isocamphylcyclohexanol, trans-;3-(5,5,6-Trimethylbicyclo(2.2.1)hept-2-yl)cyclohexan-1-ol;3-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)cyclohexan-1-ol;34UP96K73Z;3-(5,5,6-trimethylbicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol;3-{5,5,6-trimethylbicyclo[2.2.1]heptan-2-yl}cyclohexan-1-ol;3-(5-Isocamphyl)-1-cyclophexanol;3-Isocamphylcyclohexanol;SCHEMBL891473;CHEMBL3182308;DTXCID3024817;CHEBI:171884;(1S*,3S*)-(1alpha,2alpha,4alpha,6alpha)-3-(5,5,6-Trimethylbicyclo(2.2.1)hept-2-yl)cyclohexan-1-ol;4105-12-8;EINECS 223-879-4;Tox21_301776;NCGC00256284-01;CAS-3407-42-9;(5,5,6-trimethyl-2-norbornyl)-Cyclohexanol;Cyclohexanol, 3-(5,6,6-trimethyl-2-norbornyl)-;1-(5,5,6-Trimethyl-2-norbornyl)cyclohexanol, 8CI;Q4407886;3-(5,5,6-Trimethylbicyclo(2.2.1)hept-2-yl)-Cyclohexanol;3-[5,5,6-trimethylbicyclo[2.2.1]hept-2-yl ]cyclohexan-1-ol;4-(1,7,7-trimethyl-6-bicyclo[2.2.1]heptanyl )cyclohexan-1-ol;3 - (5,5,6 - trimethylbicyclo(2.2.1)hept - 2 - yl) cyclohexan - 1 - ol;Cyclohexanol, 3-(5,5,6-trimethylbicyclo(2.2.1)hept-2-yl)-, (1alpha,2alpha(1S,3S),4alpha,6alpha)-

Chemical Property of 3-[5,5,6-Trimethylbicyclo[2.2.1]hept-2-yl]cyclohexan-1-ol

Chemical Property:

• Vapor Pressure: 0.002Pa at 25℃
• Refractive Index: n20/D 1.496(lit.)
• Boiling Point: 318.334 °C at 760 mmHg
• PKA: 15.28±0.40(Predicted)
• Flash Point: 133.857 °C
• PSA: 20.23000
• Density: 1.004 g/cm³
• LogP: 3.85580
• Solubility.: 1000g/L in organic solvents at 20 ℃
• Water Solubility.: Insoluble in Water
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 236.214015512
• Heavy Atom Count: 17
• Complexity: 296

Purity/Quality:

99.9% ^*data from raw suppliers

ISOBORNYL CYCLOHEXANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1C2CC(C1(C)C)CC2C3CCCC(C3)O
• Description: Isobornyl cyclohexanol is a synthetic fragrant ingredient used to mimic sandalwood and vetiver woody notes.lsobornyl cyclohexanol is a colorless to pale yellow clear very viscous liquid to solid; its odor type is woody and itsodor at 100% is described as "woody clean sandalwood balsam". t is used in perfumes for fine fragrances, laundrycare, and soap as a low cost replacement for sandalwood oil. it is a syntheticfragrance not found in nature (and consequently, not in essential oils(5)).

Technology Process of 3-[5,5,6-Trimethylbicyclo[2.2.1]hept-2-yl]cyclohexan-1-ol

There total 10 articles about 3-[5,5,6-Trimethylbicyclo[2.2.1]hept-2-yl]cyclohexan-1-ol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ cis-3-Isocamphylcyclohexanol (3407-42-9,4105-12-8,24739-39-7,25274-67-3,25274-72-0,25274-74-2,26399-26-8,131433-96-0,131433-97-1,131433-99-3,131434-00-9,131434-05-4,131434-06-5,131434-09-8,131434-10-1)

Guidance literature:

m-(exo-Isocamphyl)phenol, H2, Eg., PtO2, Raumtemp.;

Reference yield:

→ sandela (3407-42-9)

Guidance literature:

Hexenon, H2;

Reference yield:

→ trans-3-Isocamphylcyclohexanol (3407-42-9,4105-12-8,24739-39-7,25274-67-3,25274-72-0,25274-74-2,26399-26-8,131433-96-0,131433-97-1,131433-99-3,131434-00-9,131434-05-4,131434-06-5,131434-09-8,131434-10-1)

Guidance literature:

m-(exo-Isocamphyl)phenol, H2, Eg., PtO2, Raumtemp.;