Description

Methyl 4-(hydroxymethyl)cyclohexanecarboxylate (CAS: 110928-44-4) is a high-purity cyclohexane derivative with the molecular formula C₉H₁₆O₃. This compound features both a hydroxymethyl and a methyl ester functional group attached to a cyclohexane ring, making it a versatile intermediate in organic synthesis and pharmaceutical research. Available as a colorless to pale-yellow liquid or solid, it is characterized by its excellent stability and solubility in common organic solvents such as ethanol, methanol, and dichloromethane. Ideal for researchers and scientists, this product is rigorously tested via GC, HPLC, and NMR to ensure ≥95% purity, meeting the stringent requirements of laboratory and industrial applications. Proper storage conditions (2-8°C, inert atmosphere) are recommended to maintain its integrity.

Properties

• CAS Number: 110928-44-4
• Complexity: 148
• IUPAC Name: methyl 4-(hydroxymethyl)cyclohexanecarboxylate
• InChI: InChI=1S/C9H16O3/c1-12-9(11)8-4-2-7(6-10)3-5-8/h7-8,10H,2-6H2,1H3
• InChI Key: KOGYKIDJFOMAOF-UHFFFAOYSA-N
• Exact Mass: 172.109944368
• Molecular Formula: C9H16O3
• Molecular Weight: 172.22
• SMILES: COC(=O)C1CCC(CC1)CO
• Topological: 46.5
• Monoisotopic Mass: 172.109944368
• Synonyms: 110928-44-4, methyl 4-(hydroxymethyl)cyclohexanecarboxylate, 13380-85-3, trans-Methyl 4-(hydroxymethyl)cyclohexanecarboxylate, (1r,4r)-methyl 4-(hydroxymethyl)cyclohexanecarboxylate, 110928-45-5, METHYL TRANS-4-HYDROXYMETHYLCYCLOHEXANECARBOXYLATE, Methyl 4-(hydroxymethyl)cyclohexane-1-carboxylate, Cyclohexanecarboxylic acid, 4-(hydroxymethyl)-, methyl ester, cis-, METHYL CIS-4-HYDROXYMETHYLCYCLOHEXANE-1-CARBOXYLATE, Methyl trans-4-(hydroxymethyl)cyclohexanecarboxylate, methyl (1r,4r)-4-(hydroxymethyl)cyclohexane-1-carboxylate, Cyclohexanecarboxylic acid, 4-(hydroxymethyl)-, methyl ester, trans-, 4-hydroxymethyl-cyclohexanecarboxylic acid methyl ester, MFCD03840884, cis-methyl 4-(hydroxymethyl)cyclohexanecarboxylate, cis-4-(Methoxycarboxyl)cyclohexanemethanol, M86577ODUE, R58V1A8V4H, Methyl 4-hydroxymethylcyclohexanecarboxylate, cis-, Methyl 4-hydroxymethylcyclohexanecarboxylate, trans-4-(Methoxycarbonyl)cyclohexanemethanol, Methyl 4-hydroxymethylcyclohexanecarboxylate, trans-, trans-4-(Hydroxymethyl)cyclohexanecarboxylic acid methyl ester, MFCD06799220, MFCD02260048, methyl trans-4-(hydroxymethyl)cyclohexane-1-carboxylate, UNII-M86577ODUE, UNII-R58V1A8V4H, SCHEMBL351398, SCHEMBL351399, SCHEMBL408809, cis-4-hydroxymethyl-cyclohexanecarboxylic acid methyl ester, DTXSID00928275, KOGYKIDJFOMAOF-OCAPTIKFSA-N, KOGYKIDJFOMAOF-ZKCHVHJHSA-N, Cyclohexanecarboxylic acid, 4-(hydroxymethyl)-, methyl ester, DTXSID401230262, trans-4-hydroxymethyl-cyclohexanecarboxylic acid methyl ester, UNII-93403M505F, BCP27209, CS-D1138, NAA38085, AKOS005145544, AKOS006284052, AKOS015851380, 1-(Carbomethoxy)cyclohexane-4-carbinol, DS-5562, SB11024, SB32898, AS-77731, DS-15567, FM143110, SY013329, SY098890, DB-197966, 93403M505F, CS-0150732, CS-0362764, methyl 4-hydroxymethyl cyclohexane carboxylate, cis-methyl 4-hydroxymethylcyclohexanecarboxylate, D93334, EN300-173004, EN300-396295, F30207, P10279, P15628, trans-methyl 4-hydroxymethylcyclohexanecarboxylate, Methyl cis-4-(hydroxymethyl)cyclohexanecarboxylate, 4-Hydroxymethylcyclohexanecarboxylic acid methyl ester, methyl trans-4-(hydroxymethyl)cyclohexane-carboxylate, Q27283613, Q27287806, trans-methyl 4-(hydroxymethyl)cyclohexane carboxylate, 4-hydroxymethyl-cyclohexane carboxylic acid methyl ester, METHYLTRANS-4-HYDROXYMETHYLCYCLOHEXANECARBOXYLATE, trans-4-(Hydroxymethyl)cyclohexanecarboxylic acid, methyl ester, METHYL (1S,4S)-4-(HYDROXYMETHYL)CYCLOHEXANE-1-CARBOXYLATE, Cyclohexanecarboxylic acid pound not 4-(hydroxymethyl)- pound not methyl ester pound not cis-, Methyl trans-4-(Hydroxymethyl)cyclohexanecarboxylate; trans-4-(Hydroxymethyl)cyclohexanecarboxylic Acid Methyl Ester; trans-4-(Methoxycarbonyl)cyclohexanemethanoltrans-Methyl 4-(Hydroxymethyl)cyclohexane-1-carboxylate; trans-Methyl 4-(Hydroxymethyl)cyclohexanecarboxylate

Application

Methyl 4-(hydroxymethyl)cyclohexanecarboxylate serves as a key intermediate in the synthesis of pharmaceutical compounds, particularly in the development of chiral molecules and bioactive agents. Its hydroxymethyl and ester functionalities make it valuable for polymer chemistry, where it acts as a monomer or crosslinking agent. Additionally, this compound is utilized in fragrance and flavor industries due to its potential as a precursor for cyclohexane-based aroma chemicals.

Safety and Hazards

GHS Hazard Statements

• H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
• H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
• H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Precautionary Statements

• P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Hazard Classes and Categories

• Skin Irrit. 2 (100%)
• Eye Irrit. 2A (100%)
• STOT SE 3 (100%)

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Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.