(S)-3-methylnonanoic acid
TL;DR: (S)-3-methylnonanoic acid (CAS 59614-86-7) is a chemical compound with molecular formula C10H20O2 and molecular weight 172.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylnonanoic acid
Also Known As: 3-Methylnonanoic acid, (S)-3-Methylnonanoic acid, 3-methyl-nonanoic acid, Nonanoic acid,3-methyl-, Nonanoic acid, 3-methyl-
| Molecular Formula | C10H20O2 |
|---|---|
| Molecular Weight | 172.15 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 172.14633 |
| Heavy Atoms | 12 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 59614-86-7 |
|---|---|
| SMILES | CCCCCCC(C)CC(=O)O |
| InChIKey | ZDIXEQISPGRDEB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(S)-3-methylnonanoic acid (CAS 59614-86-7), with molecular formula C10H20O2 and molecular weight 172.15 g/mol. IUPAC: 3-methylnonanoic acid.
Chemical Property Profile of (S)-3-methylnonanoic acid
Property Insights of (S)-3-methylnonanoic acid
The XLogP value of 3.8 indicates that (S)-3-methylnonanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, (S)-3-methylnonanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-3-methylnonanoic acid has 1 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 (S)-3-methylnonanoic acid?
The CAS number of (S)-3-methylnonanoic acid is 59614-86-7.
What is the molecular formula of (S)-3-methylnonanoic acid?
The molecular formula of (S)-3-methylnonanoic acid is C10H20O2.
What is the molecular weight of (S)-3-methylnonanoic acid?
The molecular weight of (S)-3-methylnonanoic acid is 172.15 g/mol.
Where can I buy (S)-3-methylnonanoic acid?
You can request a quote for (S)-3-methylnonanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-3-methylnonanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-3-methylnonanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.