4-Nonenoic acid, methyl ester
TL;DR: 4-Nonenoic acid, methyl ester (CAS 20731-19-5) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl non-4-enoate
Also Known As: methyl,4-nonenoate, Methyl-4-Nonenoat, 4-Nonenoic acid, methyl ester, METHYL NON-4-ENOATE, 4-Nonenoicacidmethylester
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 20731-19-5 |
|---|---|
| SMILES | CCCCC=CCCC(=O)OC |
| InChIKey | KPBDKJYRYZNWGX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Nonenoic acid, methyl ester (CAS 20731-19-5), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: methyl non-4-enoate.
Chemical Property Profile of 4-Nonenoic acid, methyl ester
Property Insights of 4-Nonenoic acid, methyl ester
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nonenoic acid, methyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, 4-Nonenoic acid, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Nonenoic acid, methyl ester 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 4-Nonenoic acid, methyl ester?
The CAS number of 4-Nonenoic acid, methyl ester is 20731-19-5.
What is the molecular formula of 4-Nonenoic acid, methyl ester?
The molecular formula of 4-Nonenoic acid, methyl ester is C10H18O2.
What is the molecular weight of 4-Nonenoic acid, methyl ester?
The molecular weight of 4-Nonenoic acid, methyl ester is 170.13 g/mol.
Where can I buy 4-Nonenoic acid, methyl ester?
You can request a quote for 4-Nonenoic acid, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nonenoic acid, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Nonenoic acid, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.