2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid
TL;DR: 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid (CAS 254737-30-9) is a chemical compound with molecular formula C9H16O4S and molecular weight 220.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methyl-3-sulfanylpropyl)pentanedioic acid
Also Known As: 2-(2-methyl-3-sulfanylpropyl)pentanedioic acid, 2-(3-Mercapto-2-methylpropyl)pentanedioic acid, 2-(2-methyl-3-sulfanyl-propyl)pentanedioic Acid
| Molecular Formula | C9H16O4S |
|---|---|
| Molecular Weight | 220.08 g/mol |
| LogP | 1.508 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 220.07693 |
| Heavy Atoms | 14 |
| Complexity | 204.98863 |
Chemical Identifiers
| CAS Number | 254737-30-9 |
|---|---|
| SMILES | CC(CC(CCC(=O)O)C(=O)O)CS |
Product Overview
2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid (CAS 254737-30-9), with molecular formula C9H16O4S and molecular weight 220.08 g/mol. IUPAC: 2-(2-methyl-3-sulfanylpropyl)pentanedioic acid.
Chemical Property Profile of 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid
Property Insights of 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid
The XLogP value of 1.508 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid. Following Lipinski's Rule of Five, 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid has 3 hydrogen bond donor(s) and 3 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 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid?
The CAS number of 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid is 254737-30-9.
What is the molecular formula of 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid?
The molecular formula of 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid is C9H16O4S.
What is the molecular weight of 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid?
The molecular weight of 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid is 220.08 g/mol.
Where can I buy 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid?
You can request a quote for 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methyl-3-sulfanylpropyl)pentanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.