Tert-butyl (4-hydroxycyclohexyl)carbamate

Base Information

• Chemical Name: Tert-butyl (4-hydroxycyclohexyl)carbamate
• CAS No.: 111300-06-2
• Molecular Formula: C11H21NO3
• Molecular Weight: 215.293
• Hs Code.: 2924299090
• European Community (EC) Number: 674-501-3,835-524-6
• DSSTox Substance ID: DTXSID001347011
• Nikkaji Number: J2.774.031F
• ChEMBL ID: CHEMBL4538099
• Mol file: 111300-06-2.mol

Synonyms:111300-06-2;167081-25-6;224309-64-2;tert-butyl (4-hydroxycyclohexyl)carbamate;trans-4-Boc-aminocyclohexanol;TERT-BUTYL CIS-4-HYDROXYCYCLOHEXYLCARBAMATE;4-(BOC-AMINO)CYCLOHEXANOL;boc-trans-4-aminocyclohexanol;tert-Butyl (trans-4-hydroxycyclohexyl)carbamate;trans-4-(Boc-amino)cyclohexanol;tert-butyl (cis-4-hydroxycyclohexyl)carbamate;tert-butyl N-(4-hydroxycyclohexyl)carbamate;(4-HYDROXY-CYCLOHEXYL)-CARBAMIC ACID TERT-BUTYL ESTER;trans-n-4-boc-aminocyclohexanol;trans-n-boc-4-amino-cyclohexanol;4-N-BOC-AMINO-CYCLOHEXANOL;CIS-4-(BOC-AMINO)CYCLOHEXANOL;tert-butyl 4-hydroxycyclohexylcarbamate;cis-(4-hydroxy-cyclohexyl)-carbamic acid tert-butyl ester;trans-4-(tert-Butoxycarbonylamino)cyclohexanol;cis-(4-Hydroxycyclohexyl)carbamic acid tert-butyl ester;tert-butyl (1r,4r)-4-hydroxycyclohexylcarbamate;trans-4-Boc-amino-1-cyclohexanol;trans-(4-hydroxy-cyclohexyl)-carbamic acid tert-butyl ester;MFCD03844613;4-(tert-Butoxycarbonylamino)cyclohexanol;CIS-4-(TERT-BUTOXYCARBONYLAMINO)CYCLOHEXANOL;tert-butyl N-[cis-4-hydroxycyclohexyl]carbamate;Carbamic acid, (trans-4-hydroxycyclohexyl)-, 1,1-dimethylethyl ester;CIS-TERT-BUTYL 4-HYDROXYCYCLOHEXYLCARBAMATE;MFCD03844614;MFCD06658349;Carbamic acid, (cis-4-hydroxycyclohexyl)-, 1,1-dimethylethyl ester;tert-butyl trans-4-hydroxycyclohexylcarbamate;CARBAMIC ACID, (4-HYDROXYCYCLOHEXYL)-, 1,1-DIMETHYLETHYL ESTER;Carbamic acid, N-(trans-4-hydroxycyclohexyl)-, 1,1-dimethylethyl ester;trans-tert-Butyl (4-hydroxycyclohexyl)carbamate;(4-Hydroxycyclohexyl)carbamic Acid tert-Butyl Ester;4-(Boc-amino)cyclohexan-1-ol;cis-4-(Boc-amino)cyclohexan-1-ol;4-N-BOC-AMINocycloHEXANOL;Tert-butylcis-4-hydroxycyclohexylcarbamate;tert-butyl ((1s,4s)-4-hydroxycyclohexyl)carbamate;CIS-N-BOC-4-AMINO-CYCLOHEXANOL;trans-4-Boc- Aminocyclohexanol;tert-butyl N-[(1s,4s)-4-hydroxycyclohexyl]carbamate;tert-butyl cis-4-hydroxycyclohexanecarbamate;n-boc-4-aminocyclohexanol;trans-tert-Butyl-4-hydroxycyclohexylcarbamate;SCHEMBL746168;SCHEMBL746169;SCHEMBL1204562;SCHEMBL8292365;tert-butyl N-[(1r,4r)-4-hydroxycyclohexyl]carbamate;trans-4-n-boc-aminocyclohexanol;CHEMBL4538099;SCHEMBL12157370;trans-N-Boc-4-Aminocyclohexanol;AMY2434;AMY7864;N-4-BOC-AMINOCYCLOHEXANOL;trans-(4-Hydroxycyclohexyl)carbamic acid tert-butyl ester;4-(N-Boc-amino)-1-cyclohexanol;n-t-boc-trans-4-aminocyclohexanol;DTXSID001347011;BCP26848;cis-4-(N-BOC-amino)-cyclohexanol;N-Boc-trans-1-amino-4-cyclohexanol;AB1178;AB8310;STL133426;trans-4-(N-BOC-amino)-cyclohexanol;AKOS005068022;AKOS005259016;AKOS015841326;CARBAMIC ACID, N-(CIS-4-HYDROXYCYCLOHEXYL)-, 1,1-DIMETHYLETHYL ESTER;t-butyl (4-hydroxycyclohexyl)carbamate;AC-9183;CS-W003130;CS-W008372;CS-W022973;MB03939;N-BOC-TRANS-4-AMINOCYCLOHEXANOL;PB10279;PB29285;PS-4868;SB20768;tert-Butyl-4-hydroxycyclohexylcarbamate;tert-butyl 4-hydroxycyclohexyl-carbamate;AC-33888;AM807482;AS-11261;DS-11300;SY005434;SY019657;SY022809;TRANS-4-(BOC-AMINO)-CYCLOHEXANOL;TS-03801;t-Butyl (cis-4-hydroxycyclohexyl)carbamate;tert-Butyl-cis-4-hydroxycyclohexylcarbamate;trans-4-aminocyclohexanol, n-boc protected;t-butyl trans-4-hydroxycyclohexyl-carbamate;trans-4-(t-butoxycarbonylamino)cyclohexanol;trans-4-tert-butoxycarbonylaminocyclohexanol;B3564;B4714;B5367;FT-0600877;FT-0650782;FT-0650839;tert-Butyl(cis-4-hydroxycyclohexyl)carbamate;trans-4-tert-butoxycarbonylamino-cyclohexanol;(t-butoxy)-n-(4-hydroxycyclohexyl)carboxamide;EN300-61962;tert-butyl (cis)-4-hydroxycyclohexylcarbamate;tert-Butyl trans-4-hydroxycyclohexanecarbamate;tert-butyl(trans)-4-hydroxycyclohexylcarbamate;tert-butyl(trans-4-hydroxycyclohexyl)carbamate;trans-4-boc-aminocyclohexanol 111300-06-2;trans-4-tert-butyloxycarbonylaminocyclohexanol;cis-4-(tert.butyloxycarbonylamino)-cyclohexanol;EN300-112640;EN300-152929;tert-butyl (trans)-4-hydroxycyclohexylcarbamate;4-hydroxycyclohexylcarbamic acid tert-butyl ester;N-tert-butyloxycarbonyl-trans-4-aminocyclohexanol;tert-butyl (1s,4s)-4-hydroxycyclohexylcarbamate;tert-butyl (trans-4-hydroxycyclohexyl)-carbamate;trans-4-(N-tert-butoxycarbonylamino)cyclohexanol;4-[(TERT-BUTOXYCARBONYL)AMINO]CYCLOHEXANOL;A849179;A882282;tert-butyl trans-N-(4-hydroxycyclohexyl)carbamate;A1-51518;Q-103233;Q-103234;tert-butyl (trans +/-)-4-hydroxycyclohexylcarbamate;trans-(t-butoxy)-n-(4-hydroxycyclohexyl)carboxamide;trans-tert-butoxy-n-(4-hydroxycyclohexyl)carboxamide;1,1-dimethylethyl (trans-4-hydroxycyclohexyl)carbamate;4beta-(tert-Butoxycarbonylamino)cyclohexane-1alpha-ol;trans-(t-butoxy)-n-(4-hydroxycyclohexyl)-carboxamide;trans-tert-butoxy-n-(4-hydroxycyclohexyl) carboxamide;(trans-4-hydroxycyclohexyl)carbamic acid tert-butyl ester;F2167-1212;tert-Butyl N-(4-hydroxycyclohexyl)carbamate, AldrichCPR;Z1505691082;Z425789898;(trans-4-hydroxy-cyclohexyl)-carbamic acid tert-butyl ester;(trans-4-hydroxy-cyclohexyl)carbamic acid tert-butyl ester;cis (4-Hydroxy-cyclohexyl)-carbamic acid tert-butyl ester;trans (4-Hydroxy-cyclohexyl)-carbamic acid tert-butyl ester;(1R,4R)-(4-Hydroxy-cyclohexyl)carbamic acid tert-butyl ester;(cis)-(4-hydroxy-cyclohexyl)-carbamic acid tert-butyl ester;Carbamic acid,N-(cis-4-hydroxycyclohexyl)-,1,1-dimethylethyl ester;(4-Hydroxy-cyclohexyl)-carbamic acid tert-butyl ester;4-(Boc-amino)cyclohexanol

Chemical Property of Tert-butyl (4-hydroxycyclohexyl)carbamate

Chemical Property:

• Appearance/Colour: White to off-white powder
• Vapor Pressure: 7.02E-06mmHg at 25°C
• Melting Point: 172-173 °C
• Refractive Index: 1.485
• Boiling Point: 337.714 °C at 760 mmHg
• PKA: 12.36±0.40(Predicted)
• Flash Point: 158.044 °C
• PSA: 58.56000
• Density: 1.066 g/cm³
• LogP: 2.20550
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Solubility.: Chloroform. Ethyl Acetate
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 215.15214353
• Heavy Atom Count: 15
• Complexity: 214

Purity/Quality:

98%,99%, ^*data from raw suppliers

trans-4-(Boc-amino)cyclohexanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NC1CCC(CC1)O
• Uses: trans-4-(Boc-amino)cyclohexanol is an intermediate in the synthesis of potent activators of Heme-regulated inhibitor kinase.

Technology Process of Tert-butyl (4-hydroxycyclohexyl)carbamate

There total 8 articles about Tert-butyl (4-hydroxycyclohexyl)carbamate 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: 100.0%

di-tert-butyl dicarbonate (24424-99-5) + trans-4-aminocyclohexanol hydrochloride (50910-54-8) → trans-tert-butyl 4-hydroxycyclohexylcarbamate (111300-06-2)

Guidance literature:

trans-4-aminocyclohexanol hydrochloride; With sodium hydroxide; In 1,4-dioxane; water; at 0 ℃; for 0.25h;

di-tert-butyl dicarbonate; In 1,4-dioxane; water; at 20 ℃; for 14h;

Reference yield: 98.7%

→ trans-tert-butyl 4-hydroxycyclohexylcarbamate (111300-06-2)

Guidance literature:

Reference yield: 97.0%

di-tert-butyl dicarbonate (24424-99-5) + trans-4-hydroxycyclohexylamine (27489-62-9) → trans-tert-butyl 4-hydroxycyclohexylcarbamate (111300-06-2)

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃; for 14h;

upstream raw materials:

di-tert-butyl dicarbonate

trans-4-aminocyclohexanol hydrochloride

trans-4-hydroxycyclohexylamine

tert-butyldicarbonate

Downstream raw materials:

trans-4-({[(1,1-dimethylethyl)oxy]carbonyl}amino)cyclohexyl (1R,2R,4S,6R,7R,9R)-4-ethenyl-2,4,7,14-tetramethyl-9-(methyloxy)-3-oxotricyclo[5.4.3.0(1,8)]tetradec-6-yl imidodicarbonate

tert-butyl cis-4-(iodo)cyclohexylcarbamate

4-(tert-butoxycarbonylamino)-1-cyclohexene

trans-4-(5-fluoro-2-nitro-phenoxy)-cyclohexylamine hydrochloride

Refernces

• 1、 Harty, Matthew,Nagar, Mitesh,Atkinson, Logan,Legay, Christina M.,Derksen, Darren J.,Bearne, Stephen L.. "Inhibition of serine and proline racemases by substrate-product analogues". . p. 390 - 393. Retrieved 2014.
• 2、 -. "TEAD INHIBITORS AND USES THEREOF". Paragraph 00465; 00701. . Retrieved 2020/12/11.
• 3、 Bergander, Klaus,Glorius, Frank,Heusler, Arne,Wollenburg, Marco. "Trans-Selective and Switchable Arene Hydrogenation of Phenol Derivatives". . p. 11365 - 11370. Retrieved 2020/11/24.