(S)-3-methyl-pentanoic acid
TL;DR: (S)-3-methyl-pentanoic acid (CAS 22160-40-3) is a chemical compound with molecular formula C6H12O2 and molecular weight 116.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-methylpentanoic acid
Also Known As: (S)-3-Methyl-pentanoic acid, (3S)-3-methylpentanoic acid, (S)-3-Methylpentanoic acid, (S)-3-Methylvaleric Acid, null
| Molecular Formula | C6H12O2 |
|---|---|
| Molecular Weight | 116.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 116.08373 |
| Heavy Atoms | 8 |
| Complexity | 78.0 |
Chemical Identifiers
| CAS Number | 22160-40-3 |
|---|---|
| SMILES | CC[C@H](C)CC(=O)O |
| InChIKey | IGIDLTISMCAULB-YFKPBYRVSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(S)-3-methyl-pentanoic acid (CAS 22160-40-3), with molecular formula C6H12O2 and molecular weight 116.08 g/mol. IUPAC: (3S)-3-methylpentanoic acid.
Chemical Property Profile of (S)-3-methyl-pentanoic acid
Property Insights of (S)-3-methyl-pentanoic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-3-methyl-pentanoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, (S)-3-methyl-pentanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-3-methyl-pentanoic 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-methyl-pentanoic acid?
The CAS number of (S)-3-methyl-pentanoic acid is 22160-40-3.
What is the molecular formula of (S)-3-methyl-pentanoic acid?
The molecular formula of (S)-3-methyl-pentanoic acid is C6H12O2.
What is the molecular weight of (S)-3-methyl-pentanoic acid?
The molecular weight of (S)-3-methyl-pentanoic acid is 116.08 g/mol.
Where can I buy (S)-3-methyl-pentanoic acid?
You can request a quote for (S)-3-methyl-pentanoic 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-methyl-pentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-3-methyl-pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.