五氯代十八烷酸甲酯
TL;DR: 五氯代十八烷酸甲酯 (CAS 26638-28-8) is a chemical compound with molecular formula C19H33Cl5O2 and molecular weight 468.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
五氯代十八烷酸甲酯
methyl 2,5,11,14,18-pentachlorooctadecanoate
Also Known As: Methyl pentachlorostearate, Methylpentachlorostearate, Methyl pentachlorooctadecanoate, methyl 2,5,11,14,18-pentachlorooctadecanoate, Octadecanoic acid, pentachloro-, methyl ester
| Molecular Formula | C19H33Cl5O2 |
|---|---|
| Molecular Weight | 468.09 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Exact Mass | 470.08936 |
| Heavy Atoms | 26 |
| Complexity | 344.0 |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 26638-28-8 |
|---|---|
| SMILES | COC(=O)C(CCC(CCCCCC(CCC(CCCCCl)Cl)Cl)Cl)Cl |
| InChIKey | PRZYKDRCYOLTQA-UHFFFAOYSA-N |
Product Overview
五氯代十八烷酸甲酯 (CAS 26638-28-8), with molecular formula C19H33Cl5O2 and molecular weight 468.09 g/mol. IUPAC: methyl 2,5,11,14,18-pentachlorooctadecanoate.
Chemical Property Profile of 五氯代十八烷酸甲酯
Property Insights of 五氯代十八烷酸甲酯
The XLogP value of 7.8 indicates that 五氯代十八烷酸甲酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 五氯代十八烷酸甲酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 五氯代十八烷酸甲酯 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 五氯代十八烷酸甲酯?
The CAS number of 五氯代十八烷酸甲酯 is 26638-28-8.
What is the molecular formula of 五氯代十八烷酸甲酯?
The molecular formula of 五氯代十八烷酸甲酯 is C19H33Cl5O2.
What is the molecular weight of 五氯代十八烷酸甲酯?
The molecular weight of 五氯代十八烷酸甲酯 is 468.09 g/mol.
Where can I buy 五氯代十八烷酸甲酯?
You can request a quote for 五氯代十八烷酸甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 五氯代十八烷酸甲酯?
Yes, KEHONG BIO provides custom synthesis services for 五氯代十八烷酸甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.