Methyl (E)-9-methyldec-7-enoate
TL;DR: Methyl (E)-9-methyldec-7-enoate (CAS 112375-55-0) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-9-methyldec-7-enoate
Also Known As: Methyl (E)-9-methyldec-7-enoate, Dec-7-enoic acid, 9-methyl-, methyl ester, (E)-
| Molecular Formula | C12H22O2 |
|---|---|
| Molecular Weight | 198.16 g/mol |
| LogP | 3.3221 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 198.16199 |
| Heavy Atoms | 14 |
| Complexity | 171.16054 |
Chemical Identifiers
| CAS Number | 112375-55-0 |
|---|---|
| SMILES | CC(C)/C=C/CCCCCC(=O)OC |
Product Overview
Methyl (E)-9-methyldec-7-enoate (CAS 112375-55-0), with molecular formula C12H22O2 and molecular weight 198.16 g/mol. IUPAC: methyl (E)-9-methyldec-7-enoate.
Chemical Property Profile of Methyl (E)-9-methyldec-7-enoate
Property Insights of Methyl (E)-9-methyldec-7-enoate
The XLogP value of 3.3221 indicates that Methyl (E)-9-methyldec-7-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)-9-methyldec-7-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl (E)-9-methyldec-7-enoate 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 (E)-9-methyldec-7-enoate?
The CAS number of Methyl (E)-9-methyldec-7-enoate is 112375-55-0.
What is the molecular formula of Methyl (E)-9-methyldec-7-enoate?
The molecular formula of Methyl (E)-9-methyldec-7-enoate is C12H22O2.
What is the molecular weight of Methyl (E)-9-methyldec-7-enoate?
The molecular weight of Methyl (E)-9-methyldec-7-enoate is 198.16 g/mol.
Where can I buy Methyl (E)-9-methyldec-7-enoate?
You can request a quote for Methyl (E)-9-methyldec-7-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl (E)-9-methyldec-7-enoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl (E)-9-methyldec-7-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.