Methyl (E)-12,13-dichlorooctadec-9-enoate
TL;DR: Methyl (E)-12,13-dichlorooctadec-9-enoate (CAS 138834-42-1) is a chemical compound with molecular formula C19H34Cl2O2 and molecular weight 364.19357 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (E)-12,13-dichlorooctadec-9-enoate
Also Known As: Methyl (E)-12,13-dichlorooctadec-9-enoate
Technical Specifications
| Molecular Formula | C19H34Cl2O2 |
| Molecular Weight | 364.19357 g/mol |
| XLogP | 7.5 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 16 |
| Exact Mass | 364.19357 Da |
| Heavy Atoms | 23 |
| Complexity | 306.0 |
| SMILES | CCCCCC(C(C/C=C/CCCCCCCC(=O)OC)Cl)Cl |
| InChIKey | BKMMQENVVOQVGE-FMIVXFBMSA-N |
Chemical Property Profile of Methyl (E)-12,13-dichlorooctadec-9-enoate
Property Insights of Methyl (E)-12,13-dichlorooctadec-9-enoate
The XLogP value of 7.5 indicates that Methyl (E)-12,13-dichlorooctadec-9-enoate 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 (E)-12,13-dichlorooctadec-9-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl (E)-12,13-dichlorooctadec-9-enoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Methyl (E)-12,13-dichlorooctadec-9-enoate?
The CAS number of Methyl (E)-12,13-dichlorooctadec-9-enoate is 138834-42-1.
What is the molecular formula of Methyl (E)-12,13-dichlorooctadec-9-enoate?
The molecular formula of Methyl (E)-12,13-dichlorooctadec-9-enoate is C19H34Cl2O2.
What is the molecular weight of Methyl (E)-12,13-dichlorooctadec-9-enoate?
The molecular weight of Methyl (E)-12,13-dichlorooctadec-9-enoate is 364.19357 g/mol.
Where can I buy Methyl (E)-12,13-dichlorooctadec-9-enoate?
You can request a quote for Methyl (E)-12,13-dichlorooctadec-9-enoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl (E)-12,13-dichlorooctadec-9-enoate?
Yes, CoreyChem provides custom synthesis services for Methyl (E)-12,13-dichlorooctadec-9-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.