107202-39-1

Basic information

• Product Name: N-BOC-L-CYCLOHEXYLGLYCINOL
• Synonyms: BOC-CHG-OL;N-T-BOC-L-CYCLOHEXYLGLYCINOL;N-T-BUTOXYCARBONYL-L-CYCLOHEXYLGLYCINOL;N-BOC-L-CYCLOHEXYLGLYCINOL;N-Boc-L-2-aMino-2-cyclohexyl-ethanol;N-Boc-L-cyclohexylglycinol;(S)-tert-butyl (1-cyclohexyl-2-hydroxyethyl)carbamate;(S)-2-(Boc-amino)-2-cyclohexylethanol
• CAS NO: 107202-39-1
• Molecular Formula: C₁₃H₂₅NO₃
• Molecular Weight: 243.34
• Product Categories: Amino Acid Derivatives;Amino Alcohols;Peptide Synthesis
• Mol File: 107202-39-1.mol
• Article Data: 7

Chemical Properties

• Melting Point: 83-87 °C(lit.)
• Boiling Point: 371.2 ºC at 760 mmHg
• Flash Point: 178.3 ºC
• Appearance: /
• Density: 1.037
• Vapor Pressure: 5.05E-07mmHg at 25°C
• Refractive Index: 1.482
• Storage Temp.: Store at 0-5°C
• PKA: 12.07±0.46(Predicted)
• CAS DataBase Reference: N-BOC-L-CYCLOHEXYLGLYCINOL(CAS DataBase Reference)
• NIST Chemistry Reference: N-BOC-L-CYCLOHEXYLGLYCINOL(107202-39-1)
• EPA Substance Registry System: N-BOC-L-CYCLOHEXYLGLYCINOL(107202-39-1)

Safety Data

• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38
• Safety Statements: 26
• WGK Germany: 3
• Hazardous Substances Data: 107202-39-1(Hazardous Substances Data)

Usage

Description

N-Boc-L-cyclohexylglycinol, also known as N-tert-butoxycarbonyl-L-cyclohexylglycinol, is a chemical compound characterized by the molecular formula C14H25NO4. It presents as a white to off-white crystalline powder that is soluble in organic solvents. N-Boc-L-cyclohexylglycinol is recognized for its role as a building block in the synthesis of pharmaceuticals and other organic compounds, stemming from its derivative status as a cyclohexylglycine, an amino acid with potential therapeutic applications in neurological and psychiatric disorders. Furthermore, N-Boc-L-cyclohexylglycinol has garnered interest for its utility as a chiral auxiliary in asymmetric catalysis and organic synthesis, highlighting its significance in the realms of medicinal chemistry and organic synthesis.

Uses

Used in Pharmaceutical Synthesis:
N-Boc-L-cyclohexylglycinol is used as a building block for the synthesis of various pharmaceuticals, leveraging its structural properties to contribute to the development of new medications.
Used in Organic Synthesis:
In the field of organic synthesis, N-Boc-L-cyclohexylglycinol is utilized as a chiral auxiliary, playing a crucial role in asymmetric catalysis to facilitate the production of enantiomerically pure compounds, which is vital for the creation of biologically active molecules.
Used in Medicinal Chemistry:
N-Boc-L-cyclohexylglycinol is employed in medicinal chemistry for its potential applications in the treatment of neurological and psychiatric disorders, given its relation to cyclohexylglycine, an amino acid under investigation for such therapeutic uses.
Used in Research and Development:
N-Boc-L-cyclohexylglycinol is also used in research and development settings to explore and expand the understanding of its properties and potential applications, including its role in asymmetric catalysis and its effects on neurological and psychiatric conditions.

InChI:InChI=1/C13H25NO3/c1-13(2,3)17-12(16)14-11(9-15)10-7-5-4-6-8-10/h10-11,15H,4-9H2,1-3H3,(H,14,16)/t11-/m1/s1

Upstream product

• 109183-71-3 N-(tert-butoxycarbonyl)-L-cyclohexylglycine 
• 543-27-1 isobutyl chloroformate 
• 155905-75-2 [(R)-1-(1-Benzenesulfonyl-cyclohexyl)-2-(tetrahydro-pyran-2-yloxy)-ethyl]-carbamic acid tert-butyl ester 
• 116611-45-1 (2R)-2-t-butoxycarbonylamino-3-phenylsulfonyl-1-(2-tetrahydropyranyloxy)propane 
• 54512-75-3 1-bromo-5-chloropentane 
• 14328-51-9 (2S)-amino(cyclohexyl)ethanoic acid 
• 107202-38-0 tert-butyl (S)-(methoxycarbonyl)(cyclohexyl)methylcarbamate 
• 24424-99-5 di-tert-butyl dicarbonate 
• 845714-30-9 (S)-2-amino-2-cyclohexylethan -1-ol 

Downstream Products

• 1072147-06-8 C₁₆H₂₇NO₃ 
• 1429925-31-4 2-[(4S)-7-(3-chlorophenyl)-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-4-yl]-N-{(1S)-1-cyclohexyl-2-[4-(dimethylamino)piperidin-1-yl]ethyl}acetamide 
• 1429925-20-1 N-[(1S)-1-cyclohexyl-2-(4-methylpiperazin-1-yl)ethyl]-2-[(4S)-7-(2-fluoropyridin-4-yl)-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-4-yl]acetamide 
• 1429925-34-7 2-[(4S)-7-(5-chloro-2-fluorophenyl)-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-4-yl]-N-[(1S)-1-cyclohexyl-2-(4-methylpiperazin-1-yl)ethyl]acetamide 
• 1429925-16-5 N-[(1S)-1-cyclohexyl-2-(4-methylpiperazin-1-yl)ethyl]-2-[(4S)-7-(3,4-difluorophenyl)-1-oxo-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-4-yl]acetamide 
• 1438882-87-1 (S)-1-cyclohexyl-2-(2-pyridin-4-yl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yloxy)ethylamine 
• 944144-74-5 C₁₅H₂₉NO₃ 
• 732282-83-6 (S)-3-(N-tert-butoxycarbonyl-2-amino-2-cyclohexylethyl)-1-(2,6-difluorobenzyl)-5-(2-fluoro-3-methoxyphenyl)-6-methyluracil 
• 732282-74-5 (S)-5-bromo-3-(N-tert-butoxycarbonyl-2-amino-2-cyclohexylethyl)-1-(2,6-difluorobenzyl)-6-methyluracil 
• 109183-71-3 N-(tert-butoxycarbonyl)-L-cyclohexylglycine 
• 127953-73-5 (S)-Boc-cyclohexylglycinal 

Relevant articles and documents

Immunoregulator

The invention discloses an immune regulator, in particular to a compound for inhibiting IL - 17A and application of the compound as an immunomodulator in preparation of medicines. The invention discloses a compound shown in formula I. The application of t

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Extensive SAR studies of the P3 capping group led to the discovery of a series of potent inhibitors with sultam and cyclic sulfonyl urea moieties as the P3 capping. The bicyclic thiophene-sultam or phenyl-sultam cappings were selected for further SAR development. Modification at the P3 side chain determined that the tert-butyl group was the best choice at that position. Optimization of P1 residue significantly improved potency and selectivity. The combination of optimal moieties at all positions led to the discovery of compound 33. This compound had the best overall profile in potency and PK profile: excellent Ki* of 5.3 nM and activity in replicon (EC90) of 80 nM, extremely high selectivity of 6100, and a good rat PO AUC of 1.43 μM h.

Substituted 2-arylimino heterocycles and compositions containing them, for use as progesterone receptor binding agents

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