3,3,5-Trimethylcyclohexyl formate

Base Information

• Chemical Name: 3,3,5-Trimethylcyclohexyl formate
• CAS No.: 24442-68-0
• Molecular Formula: C₁₀H₁₈O₂
• Molecular Weight: 170.252
• European Community (EC) Number: 246-250-6
• DSSTox Substance ID: DTXSID70885265
• Nikkaji Number: J287.248J
• Mol file: 24442-68-0.mol

Synonyms:3,3,5-Trimethylcyclohexyl formate;24442-68-0;Cyclohexanol, 3,3,5-trimethyl-, 1-formate;Cyclohexanol, 3,3,5-trimethyl-, formate;EINECS 246-250-6;SCHEMBL272820;DTXSID70885265;3,3,5-Trimethylcyclohexanol formate

Chemical Property of 3,3,5-Trimethylcyclohexyl formate

Chemical Property:

• Vapor Pressure: 0.289mmHg at 25°C
• Refractive Index: 1.448
• Boiling Point: 202.7°Cat760mmHg
• Flash Point: 72.9°C
• PSA: 26.30000
• Density: 0.94g/cm³
• LogP: 3.01010
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 170.130679813
• Heavy Atom Count: 12
• Complexity: 163

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC(CC(C1)(C)C)OC=O

Technology Process of 3,3,5-Trimethylcyclohexyl formate

There total 2 articles about 3,3,5-Trimethylcyclohexyl formate 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-<3,3,5-Trimethyl-cyclohexyl-(1)>-formiat (24442-68-0,60234-70-0)

Guidance literature:

/BRN= 322211/, sd. wss.fr. HCO2H;

DOI:10.1002/hlca.19640470602

Reference yield:

→ trans-<3,3,5-Trimethyl-cyclohexyl-(1)>-formiat (24442-68-0,60234-70-0)

Guidance literature:

/BRN= 203317/, sd. abs. HCO2H, 45 Std.;

DOI:10.1002/hlca.19640470602