Caryophyllene formate

Base Information

• Chemical Name: Caryophyllene formate
• CAS No.: 58096-46-1
• Molecular Formula: C16H26 O2
• Molecular Weight: 250.381
• European Community (EC) Number: 261-117-2
• DSSTox Substance ID: DTXSID50866673
• Nikkaji Number: J20.968F
• Wikidata: Q104253267
• Mol file: 58096-46-1.mol

Synonyms:caryophyllene formate;58096-46-1;UNII-6CS460KB0F;DTXSID50866673;EINECS 261-117-2;(4,4,8-trimethyl-1-tricyclo[6.3.1.02,5]dodecanyl) formate;beta-Caryophyllene alcohol formate;Tricyclo[6.3.1.02,5]dodecan-1-ol, 4,4,8-trimethyl-, formate;1-formyloxy-caryolane;caryolan;neopatchouli;4,4,8-Trimethyltricyclo(6.3.1.02,5)dodecan-1-yl formate;neo Patchouli;4,4,8-TRIMETHYLTRICYCLO[6.3.1.02,5]DODECAN-1-YL FORMATE;Tricyclo(6.3.1.02,5)dodecan-1-ol, 4,4,8-trimethyl-, formate;Q27264513;tt0815;Tricyclo(6.3.1.02,5)dodecan-1-ol, 4,4,8-trimethyl-, 1-formate;Tricyclo[6.3.1.02,5]dodecan-1-ol, 4,4,8-trimethyl-, 1-formate;4,4,8 - trimethyltricyclo(6.3.1.02,5)dodecan - 1 - yl formate

Chemical Property of Caryophyllene formate

Chemical Property:

• Vapor Pressure: 0.000827mmHg at 25°C
• Refractive Index: 1.507
• Boiling Point: 305.3°Cat760mmHg
• Flash Point: 124.7°C
• PSA: 26.30000
• Density: 1.03g/cm³
• LogP: 4.57050
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 250.193280068
• Heavy Atom Count: 18
• Complexity: 362

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CC2C1CCC3(CCCC2(C3)OC=O)C)C

Technology Process of Caryophyllene formate

There total 1 articles about Caryophyllene 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:

formic acid (64-18-6) → 1-formyloxy-caryolane (58096-46-1)

Guidance literature:

upstream raw materials:

formic acid