Dicyclohexyl tartrate

Base Information

• Chemical Name: Dicyclohexyl tartrate
• CAS No.: 15785-59-8
• Molecular Formula: C₁₆H₂₆O₆
• Molecular Weight: 314.379
• European Community (EC) Number: 239-883-4
• UNII: S140SHN6ML
• Nikkaji Number: J485.955C
• Wikidata: Q27288426
• Mol file: 15785-59-8.mol

Synonyms:Dicyclohexyl tartrate;15785-59-8;Dicyclohexyl L-tartrate;dicyclohexyl (2R,3R)-2,3-dihydroxybutanedioate;S140SHN6ML;Butanedioic acid, 2,3-dihydroxy- (2R,3R)-, 1,4-dicyclohexyl ester;UNII-S140SHN6ML;SCHEMBL13517345;EINECS 239-883-4;TARTARIC ACID, DICYCLOHEXYL ESTER;Q27288426;BUTANEDIOIC ACID, 2,3-DIHYDROXY- (2R,3R)-, DICYCLOHEXYL ESTER

Chemical Property of Dicyclohexyl tartrate

Chemical Property:

• Vapor Pressure: 4.05E-09mmHg at 25°C
• Boiling Point: 428°Cat760mmHg
• PKA: 11.09±0.20(Predicted)
• Flash Point: 149.2°C
• PSA: 93.06000
• Density: 1.21g/cm³
• LogP: 1.46000
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 314.17293854
• Heavy Atom Count: 22
• Complexity: 335

Purity/Quality:

99% ^*data from raw suppliers

DICYCLOHEXYL 2,3-DIHYDROXYBUTANEDIOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)OC(=O)C(C(C(=O)OC2CCCCC2)O)O
• Isomeric SMILES: C1CCC(CC1)OC(=O)[C@@H]([C@H](C(=O)OC2CCCCC2)O)O

Technology Process of Dicyclohexyl tartrate

There total 2 articles about Dicyclohexyl tartrate 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: 81.0%

dicyclohexyl trans-butenedioate (621-13-6,135607-72-6,47092-64-8) → dicyclohexyl tartrate (15785-59-8,83071-79-8,133098-69-8,133098-70-1,140850-35-7)

Guidance literature:

With piperidine; potassium permanganate; In acetone; for 1h; Ambient temperature;

Reference yield: 73.0%

DL-tartaric acid (133-37-9,138508-61-9) + cyclohexanol (108-93-0) → dicyclohexyl tartrate (15785-59-8,83071-79-8,133098-69-8,133098-70-1,140850-35-7)

Guidance literature:

With acidic ion exchange resin; In chloroform; for 40h; Heating;

Reference yield:

dicyclohexyl tartrate (15785-59-8,83071-79-8,133098-69-8,133098-70-1,140850-35-7) → cyclohexyl glyoxalate (133017-22-8) + Dihydroxy-acetic acid cyclohexyl ester (133017-23-9)

Guidance literature:

With periodic acid; In tetrahydrofuran; for 4h; Yield given. Title compound not separated from byproducts; Ambient temperature;

upstream raw materials:

dicyclohexyl trans-butenedioate

DL-tartaric acid

cyclohexanol

Downstream raw materials:

cyclohexyl glyoxalate

Dihydroxy-acetic acid cyclohexyl ester

Refernces