2-甲氧基苯甲酸环己酯
TL;DR: 2-甲氧基苯甲酸环己酯 (CAS 107952-97-6) is a chemical compound with molecular formula C14H18O3 and molecular weight 234.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-甲氧基苯甲酸环己酯
cyclohexyl 2-methoxybenzoate
Also Known As: Cyclohexyl 2-methoxybenzoate, 2-Methoxybenzoic acid, cyclohexyl ester, Cyclohexyl 2-methoxybenzoate #, RefChem:262747
| Molecular Formula | C14H18O3 |
|---|---|
| Molecular Weight | 234.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.1256 |
| Heavy Atoms | 17 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 107952-97-6 |
|---|---|
| SMILES | COC1=CC=CC=C1C(=O)OC2CCCCC2 |
| InChIKey | XHPHUGTZTQAPLM-UHFFFAOYSA-N |
Product Overview
2-甲氧基苯甲酸环己酯 (CAS 107952-97-6), with molecular formula C14H18O3 and molecular weight 234.13 g/mol. IUPAC: cyclohexyl 2-methoxybenzoate.
Chemical Property Profile of 2-甲氧基苯甲酸环己酯
Property Insights of 2-甲氧基苯甲酸环己酯
The XLogP value of 3.8 indicates that 2-甲氧基苯甲酸环己酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2-甲氧基苯甲酸环己酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-甲氧基苯甲酸环己酯 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-甲氧基苯甲酸环己酯?
The CAS number of 2-甲氧基苯甲酸环己酯 is 107952-97-6.
What is the molecular formula of 2-甲氧基苯甲酸环己酯?
The molecular formula of 2-甲氧基苯甲酸环己酯 is C14H18O3.
What is the molecular weight of 2-甲氧基苯甲酸环己酯?
The molecular weight of 2-甲氧基苯甲酸环己酯 is 234.13 g/mol.
Where can I buy 2-甲氧基苯甲酸环己酯?
You can request a quote for 2-甲氧基苯甲酸环己酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-甲氧基苯甲酸环己酯?
Yes, KEHONG BIO provides custom synthesis services for 2-甲氧基苯甲酸环己酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.