Methyl 7-nonynoate
TL;DR: Methyl 7-nonynoate (CAS 20731-18-4) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl non-7-ynoate
Also Known As: Methyl 7-nonynoate, methyl non-7-ynoate, Methyl 7-nonynoate #, 7-Nonynoic acid, methyl ester, 7-Nonynoic acid methyl ester
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 20731-18-4 |
|---|---|
| SMILES | CC#CCCCCCC(=O)OC |
| InChIKey | UKTSPOKRMGZPJU-UHFFFAOYSA-N |
Product Overview
Methyl 7-nonynoate (CAS 20731-18-4), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: methyl non-7-ynoate.
Chemical Property Profile of Methyl 7-nonynoate
Property Insights of Methyl 7-nonynoate
The XLogP value of 3.1 indicates that Methyl 7-nonynoate 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-nonynoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 7-nonynoate 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-nonynoate?
The CAS number of Methyl 7-nonynoate is 20731-18-4.
What is the molecular formula of Methyl 7-nonynoate?
The molecular formula of Methyl 7-nonynoate is C10H16O2.
What is the molecular weight of Methyl 7-nonynoate?
The molecular weight of Methyl 7-nonynoate is 168.12 g/mol.
Where can I buy Methyl 7-nonynoate?
You can request a quote for Methyl 7-nonynoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 7-nonynoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 7-nonynoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.