Methyl 7-octenoate
TL;DR: Methyl 7-octenoate (CAS 15766-90-2) is a chemical compound with molecular formula C9H16O2 and molecular weight 156.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl oct-7-enoate
Also Known As: Methyl 7-octenoate, methyl oct-7-enoate, 7-octenoic acid methyl ester, 7-Octenoic acid, methyl ester, ZERO/008231
| Molecular Formula | C9H16O2 |
|---|---|
| Molecular Weight | 156.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 156.11504 |
| Heavy Atoms | 11 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 15766-90-2 |
|---|---|
| SMILES | COC(=O)CCCCCC=C |
| InChIKey | WEDBJXYFCNMJKA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 7-octenoate (CAS 15766-90-2), with molecular formula C9H16O2 and molecular weight 156.12 g/mol. IUPAC: methyl oct-7-enoate.
Chemical Property Profile of Methyl 7-octenoate
Property Insights of Methyl 7-octenoate
The XLogP value of 3.1 indicates that Methyl 7-octenoate 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 7-octenoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 7-octenoate 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 7-octenoate?
The CAS number of Methyl 7-octenoate is 15766-90-2.
What is the molecular formula of Methyl 7-octenoate?
The molecular formula of Methyl 7-octenoate is C9H16O2.
What is the molecular weight of Methyl 7-octenoate?
The molecular weight of Methyl 7-octenoate is 156.12 g/mol.
Where can I buy Methyl 7-octenoate?
You can request a quote for Methyl 7-octenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 7-octenoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 7-octenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.