Methyl 2-cyclohexyl-2-methylpentanoate
TL;DR: Methyl 2-cyclohexyl-2-methylpentanoate (CAS 55030-27-8) is a chemical compound with molecular formula C13H24O2 and molecular weight 212.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-cyclohexyl-2-methylpentanoate
Also Known As: Methyl 2-cyclohexyl-2-methylpentanoate, 2-Cyclohexyl-2-methylpentanoicacidmethylester, Methyl 2-cyclohexyl-2-methylpentanoate #, 2-Cyclohexyl-2-methylpentanoic acid methyl ester, alpha-Methyl-alpha-propylcyclohexaneacetic acid methyl ester
| Molecular Formula | C13H24O2 |
|---|---|
| Molecular Weight | 212.18 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 212.17763 |
| Heavy Atoms | 15 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 55030-27-8 |
|---|---|
| SMILES | CCCC(C)(C1CCCCC1)C(=O)OC |
| InChIKey | VCCZXUFUICXVRJ-UHFFFAOYSA-N |
Product Overview
Methyl 2-cyclohexyl-2-methylpentanoate (CAS 55030-27-8), with molecular formula C13H24O2 and molecular weight 212.18 g/mol. IUPAC: methyl 2-cyclohexyl-2-methylpentanoate.
Chemical Property Profile of Methyl 2-cyclohexyl-2-methylpentanoate
Property Insights of Methyl 2-cyclohexyl-2-methylpentanoate
The XLogP value of 4.6 indicates that Methyl 2-cyclohexyl-2-methylpentanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 2-cyclohexyl-2-methylpentanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-cyclohexyl-2-methylpentanoate has 0 hydrogen bond donor(s) and 2 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 Methyl 2-cyclohexyl-2-methylpentanoate?
The CAS number of Methyl 2-cyclohexyl-2-methylpentanoate is 55030-27-8.
What is the molecular formula of Methyl 2-cyclohexyl-2-methylpentanoate?
The molecular formula of Methyl 2-cyclohexyl-2-methylpentanoate is C13H24O2.
What is the molecular weight of Methyl 2-cyclohexyl-2-methylpentanoate?
The molecular weight of Methyl 2-cyclohexyl-2-methylpentanoate is 212.18 g/mol.
Where can I buy Methyl 2-cyclohexyl-2-methylpentanoate?
You can request a quote for Methyl 2-cyclohexyl-2-methylpentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-cyclohexyl-2-methylpentanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-cyclohexyl-2-methylpentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.