稳鱼烷酸甲酯
TL;DR: 稳鱼烷酸甲酯 (CAS 18444-89-8) is a chemical compound with molecular formula C16H24O2 and molecular weight 248.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
稳鱼烷酸甲酯
methyl 7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane-2-carboxylate
Also Known As: Methyl zizanoate, Methyl ziza-6(13)-en-12-oate, 1H-3a,6-Methanoazulene-3-carboxylic acid, octahydro-7,7-dimethyl-8-methylene-, methyl ester, [3S-(3.alpha.,3a.alpha.,6.alpha.,8a.alpha.)]-, methyl 7,7-dimethyl-8-methylideneoctahydro-1h-3a,6-methanoazulene-3-carboxylate, 1H-3a,6-Methanoazulene-3-carboxylic acid, 3,3beta,4,5,6beta,7,8,8aalpha-octahydro-7,7-dimethyl-8-methylene-, methyl ester
| Molecular Formula | C16H24O2 |
|---|---|
| Molecular Weight | 248.18 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.17763 |
| Heavy Atoms | 18 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 18444-89-8 |
|---|---|
| SMILES | CC1(C2CCC3(C2)C(C1=C)CCC3C(=O)OC)C |
| InChIKey | DZVKVIGAEDEAIN-UHFFFAOYSA-N |
Product Overview
稳鱼烷酸甲酯 (CAS 18444-89-8), with molecular formula C16H24O2 and molecular weight 248.18 g/mol. IUPAC: methyl 7,7-dimethyl-6-methylidenetricyclo[6.2.1.01,5]undecane-2-carboxylate.
Chemical Property Profile of 稳鱼烷酸甲酯
Property Insights of 稳鱼烷酸甲酯
The XLogP value of 4.0 indicates that 稳鱼烷酸甲酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 稳鱼烷酸甲酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 稳鱼烷酸甲酯 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 稳鱼烷酸甲酯?
The CAS number of 稳鱼烷酸甲酯 is 18444-89-8.
What is the molecular formula of 稳鱼烷酸甲酯?
The molecular formula of 稳鱼烷酸甲酯 is C16H24O2.
What is the molecular weight of 稳鱼烷酸甲酯?
The molecular weight of 稳鱼烷酸甲酯 is 248.18 g/mol.
Where can I buy 稳鱼烷酸甲酯?
You can request a quote for 稳鱼烷酸甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 稳鱼烷酸甲酯?
Yes, KEHONG BIO provides custom synthesis services for 稳鱼烷酸甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.