[(1S,2S)-2-hydroxycyclohexyl]CarbaMic acidphenylMethyl ester

Base Information

• Chemical Name: [(1S,2S)-2-hydroxycyclohexyl]CarbaMic acidphenylMethyl ester
• CAS No.: 198422-64-9
• Molecular Formula: C14H19NO3
• Molecular Weight: 249.31
• Mol file: 198422-64-9.mol

Synonyms:[(1S,2S)-2-hydroxycyclohexyl]CarbaMic acidphenylMethyl ester

Chemical Property of [(1S,2S)-2-hydroxycyclohexyl]CarbaMic acidphenylMethyl ester

Chemical Property:

• Melting Point: 102 - 103 °C (hexane)
• Boiling Point: 427.6±44.0 °C(Predicted)
• PKA: 11.90±0.40(Predicted)
• PSA: 58.56000
• Density: 1.17±0.1 g/cm3(Predicted)
• LogP: 2.60720

Purity/Quality:

99% ^*data from raw suppliers

[(1S,2S)-2-Hydroxycyclohexyl]carbamic Acid Phenylmethyl Ester, min. 98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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Technology Process of [(1S,2S)-2-hydroxycyclohexyl]CarbaMic acidphenylMethyl ester

There total 7 articles about [(1S,2S)-2-hydroxycyclohexyl]CarbaMic acidphenylMethyl ester 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: 8.0%

DBC (3459-92-5) + (+/-)-trans-2-aminocyclohexanol (931-16-8,6850-38-0,6982-39-4,33092-82-9,38898-70-3,74111-21-0,108267-20-5,931-15-7) → (1S,2S)-N-(2-hydroxycyclohexyl)carbamate (198422-64-9)

Guidance literature:

With Candida antarctica lipase; SP 435; In 1,4-dioxane; at 30 ℃; for 24h;

DOI:10.1016/S0957-4166(97)00368-6

Reference yield:

DBC (3459-92-5) + (+/-)-trans-2-aminocyclohexanol (931-16-8,6850-38-0,6982-39-4,33092-82-9,38898-70-3,74111-21-0,108267-20-5,931-15-7) → (1S,2S)-N-(2-hydroxycyclohexyl)carbamate (198422-64-9) + (1R,2R)-2-hydroxycyclohexylcarbamic acid benzyl ester (134108-76-2)

Guidance literature:

With Candida antarctica lipase; 4 A molecular sieve; In toluene; at 24 ℃; Yield given; Yields of byproduct given. Title compound not separated from byproducts;

DOI:10.1039/a808028c

Reference yield:

allyl benzyl carbonate (22768-01-0) + (+/-)-trans-2-aminocyclohexanol (931-16-8,6850-38-0,6982-39-4,33092-82-9,38898-70-3,74111-21-0,108267-20-5,931-15-7) → (1S,2S)-N-(2-hydroxycyclohexyl)carbamate (198422-64-9) + (1R,2R)-2-hydroxycyclohexylcarbamic acid benzyl ester (134108-76-2)

Guidance literature:

With Candida antarctica lipase; SP 435; In 1,4-dioxane; at 30 ℃; for 58h; Yield given. Yields of byproduct given. Title compound not separated from byproducts;

DOI:10.1016/S0957-4166(97)00368-6

upstream raw materials:

Butyric acid (1S,2S)-2-benzyloxycarbonylamino-cyclohexyl ester

DBC

(+/-)-trans-2-aminocyclohexanol

allyl benzyl carbonate

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