Description

tert-Butyl (4-hydroxy-1-methylcyclohexyl)carbamate (CAS: 792913-83-8) is a high-purity organic compound with the molecular formula C₁₂H₂₃NO₃, widely utilized in pharmaceutical and chemical research. This carbamate derivative features a tert-butoxycarbonyl (Boc) protecting group, making it invaluable in peptide synthesis and medicinal chemistry applications. The compound exhibits excellent stability under standard conditions and is supplied as a white to off-white crystalline powder with ≥95% purity (HPLC). Its structural versatility allows for further functionalization, enabling researchers to explore novel bioactive molecules. Each batch undergoes rigorous QC testing, including NMR, LC-MS, and elemental analysis, ensuring consistency for sensitive experiments. Store in a cool, dry place at 2-8°C under inert atmosphere for prolonged shelf life.

Properties

• CAS Number: 792913-83-8
• Complexity: 249
• IUPAC Name: tert-butyl N-(4-hydroxy-1-methyl-cyclohexyl)carbamate
• InChI: InChI=1S/C12H23NO3/c1-11(2,3)16-10(15)13-12(4)7-5-9(14)6-8-12/h9,14H,5-8H2,1-4H3,(H,13,15)
• InChI Key: JJAVBBNDEUQQSR-UHFFFAOYSA-N
• Exact Mass: 229.16779360
• Molecular Formula: C12H23NO3
• Molecular Weight: 229.32
• SMILES: CC1(CCC(CC1)O)NC(=O)OC(C)(C)C
• Topological: 58.6
• Monoisotopic Mass: 229.16779360
• Synonyms: 792913-83-8, trans-4-(Boc-amino)-4-methylcyclohexanol, 412293-62-0, 412293-61-9, tert-Butyl (4-hydroxy-1-methylcyclohexyl)carbamate, tert-butyl N-(4-hydroxy-1-methylcyclohexyl)carbamate, cis-4-(Boc-amino)-4-methylcyclohexanol, tert-Butyl (cis-4-hydroxy-1-methylcyclohexyl)carbamate, tert-Butyl (trans-4-hydroxy-1-methylcyclohexyl)carbamate, (4-Hydroxy-1-methyl-cyclohexyl)-carbamic acid tert-butyl ester, MFCD23105965, tert-Butyl N-(4-hydroxy-1-methyl-cyclohexyl)carbamate, tert-Butyl ((1R, 4R)-4-hydroxy-1-methylcyclohexyl)carbamate, (4-hydroxy-1-methylcyclohexyl)Carbamic acid 1,1-dimethylethyl ester, cis-4-(Boc-amino)-4-methylcyclohexan-1-ol, trans-4-(Boc-amino)-4-methylcyclohexan-1-ol, MFCD20040473, MFCD23105964, SCHEMBL1730719, SCHEMBL15115795, DTXSID50667662, tert-butyl cis-N-(4-hydroxy-1-methyl-cyclohexyl)carbamate, JJAVBBNDEUQQSR-UHFFFAOYSA-N, DTXSID401143332, AKOS015841527, AKOS024258967, AKOS025290292, PB33761, PB38636, SB20632, SB20633, SB21795, Carbamic acid, (4-hydroxy-1-methylcyclohexyl)-, 1,1-dimethylethyl ester (9CI), tert-butyl N-[(1s,4s)-4-hydroxy-1-, AS-34691, AS-51444, AS-51781, SY099971, DB-075573, CS-0047765, CS-0048066, CS-0049689, P12690, P13519, EN300-5539972, EN300-7171175, tert-Butyl(cis-4-hydroxy-1-methylcyclohexyl)carbamate, tert-butyl (1r,4r)-4-hydroxy-1-methylcyclohexylcarbamate, TERT-BUTYL N-[(1R,4R)-4-HYDROXY-1-METHYLCYCLOHEXYL]CARBAMATE, Carbamic acid, (cis-4-hydroxy-1-methylcyclohexyl)-, 1,1-dimethylethyl ester

Application

This Boc-protected amino alcohol serves as a key intermediate in the synthesis of complex drug candidates, particularly in opioid receptor modulators and neurological therapeutics. Researchers employ it for chiral auxiliary applications due to its stereogenic center, enabling asymmetric synthesis. The hydroxyl group allows for selective derivatization while the Boc group facilitates deprotection under mild acidic conditions. It’s also used in solid-phase peptide synthesis (SPPS) and as a building block for combinatorial chemistry libraries.

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