3-Mercapto-valeric acid
TL;DR: 3-Mercapto-valeric acid (CAS 7561-23-1) is a chemical compound with molecular formula C5H10O2S and molecular weight 134.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-sulfanylpentanoic acid
Also Known As: 3-sulfanylpentanoic acid, 3-mercapto-valeric acid, Thioethyl compound, 3-mercaptovaleric acid, Pentanoic acid, 3-mercapto-
| Molecular Formula | C5H10O2S |
|---|---|
| Molecular Weight | 134.04 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 134.04015 |
| Heavy Atoms | 8 |
| Complexity | 82.0 |
Chemical Identifiers
| CAS Number | 7561-23-1 |
|---|---|
| SMILES | CCC(CC(=O)O)S |
| InChIKey | PTPQZNNAUUSACC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Mercapto-valeric acid (CAS 7561-23-1), with molecular formula C5H10O2S and molecular weight 134.04 g/mol. IUPAC: 3-sulfanylpentanoic acid.
Chemical Property Profile of 3-Mercapto-valeric acid
Property Insights of 3-Mercapto-valeric acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Mercapto-valeric acid. With a topological polar surface area (TPSA) of 38.3 Ų, 3-Mercapto-valeric acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Mercapto-valeric acid has 2 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 3-Mercapto-valeric acid?
The CAS number of 3-Mercapto-valeric acid is 7561-23-1.
What is the molecular formula of 3-Mercapto-valeric acid?
The molecular formula of 3-Mercapto-valeric acid is C5H10O2S.
What is the molecular weight of 3-Mercapto-valeric acid?
The molecular weight of 3-Mercapto-valeric acid is 134.04 g/mol.
Where can I buy 3-Mercapto-valeric acid?
You can request a quote for 3-Mercapto-valeric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Mercapto-valeric acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Mercapto-valeric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.