Cedrol formate

Base Information

• Chemical Name: Cedrol formate
• CAS No.: 39900-38-4
• Deprecated CAS: 2258643-19-3
• Molecular Formula: C16H26 O2
• Molecular Weight: 250.381
• European Community (EC) Number: 254-693-1
• DSSTox Substance ID: DTXSID00865974
• Nikkaji Number: J261.476F
• Mol file: 39900-38-4.mol

Synonyms:Cedrol formate;Cedrenyl formate;Cedryl formate;39900-38-4;EINECS 254-693-1;BRN 2526207;[(1S,2R,5S,7R,8R)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] formate;1H-3a,7-Methanoazulen-6-ol, octahydro-3,6,8,8-tetramethyl-, formate, (3R,3aS,6R,7R,8aS)-;1H-3a,7-Methanoazulen-6-ol, octahydro-3,6,8,8-tetramethyl-, formate, (3R-(3alpha,3abeta,6alpha,7beta,8aalpha))-;(3R-(3alpha,3abeta,6alpha,7beta,8aalpha))-Octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-yl formate;1H-3-alpha,7-Methanoazulen-6-ol, octahydro-3,6,8,8-tetramethyl-, formate, (3R-(3-alpha,3a-beta,6-alpha,7-beta,8a-alpha))-;[3R-(3alpha,3abeta,6alpha,7beta,8aalpha)]-octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-yl formate;SCHEMBL3506539;DTXSID00865974;(3R - (3a,3ab,6a,7b,8aa)) - octahydro - 3,6,8,8 - tetramethyl - 1H - 3a,7 - methanoazulen - 5 - yl acetate;1H-3a,7-Methanoazulen-6-ol, octahydro-3,6,8,8-tetramethyl-, formate, [3R-(3.alpha.,3a.beta.,6.alpha.,7.beta.,8a.alpha.)]-;1H-3a,7-Methanoazulen-6-ol, octahydro-3,6,8,8-tetramethyl-,formate, [3R-(3.alpha.,3a.beta.,6.alpha.,7.beta.,8a.alpha.)]-;LS-89498;1H-3a,7-Methanoazulen-6-ol, octahydro-3,6,8,8-tetramethyl-, 6-formate, (3R,3aS,6R,7R,8aS)-

Chemical Property of Cedrol formate

Chemical Property:

• Vapor Pressure: 0.000627mmHg at 25°C
• Refractive Index: 1.4342 (estimate)
• Boiling Point: 309.7oC at 760 mmHg
• Flash Point: 126.8oC
• PSA: 26.30000
• Density: 1.03g/cm3
• LogP: 4.42640
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 250.193280068
• Heavy Atom Count: 18
• Complexity: 375

Purity/Quality:

99% ^*data from raw suppliers

CEDRYL FORMATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC2C13CCC(C(C3)C2(C)C)(C)OC=O
• Isomeric SMILES: C[C@@H]1CC[C@@H]2[C@]13CC[C@@]([C@H](C3)C2(C)C)(C)OC=O

Technology Process of Cedrol formate

There total 1 articles about Cedrol 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:

→ cedryl formate (39900-38-4)

Guidance literature:

Cedrol, /BRN= 773835/;

DOI:10.1016/S0040-4039(01)94450-8