5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate
TL;DR: 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate (CAS 89-46-3) is a chemical compound with molecular formula C17H24O3 and molecular weight 276.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methyl-2-propan-2-ylcyclohexyl) 2-hydroxybenzoate
Also Known As: MENTHYL SALICYLATE, menthylsalicylat, 1-Menthyl salicylate, menthylsalicylat-, Salicylic acid menthyl
| Molecular Formula | C17H24O3 |
|---|---|
| Molecular Weight | 276.17 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.17255 |
| Heavy Atoms | 20 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 89-46-3 |
|---|---|
| SMILES | CC1CCC(C(C1)OC(=O)C2=CC=CC=C2O)C(C)C |
| InChIKey | SJOXEWUZWQYCGL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate (CAS 89-46-3), with molecular formula C17H24O3 and molecular weight 276.17 g/mol. IUPAC: (5-methyl-2-propan-2-ylcyclohexyl) 2-hydroxybenzoate.
Chemical Property Profile of 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate
Property Insights of 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate
The XLogP value of 5.4 indicates that 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate?
The CAS number of 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate is 89-46-3.
What is the molecular formula of 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate?
The molecular formula of 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate is C17H24O3.
What is the molecular weight of 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate?
The molecular weight of 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate is 276.17 g/mol.
Where can I buy 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate?
You can request a quote for 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.