1-Mercapto-2-propanol, acetate
TL;DR: 1-Mercapto-2-propanol, acetate (CAS 35508-06-6) 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.
1-sulfanylpropan-2-yl acetate
Also Known As: 2-Acetoxy-propan-1-thiol, 1-sulfanylpropan-2-yl acetate, 1-Mercapto-2-propanol, acetate, 1-Methyl-2-sulfanylethyl acetate #, Acetic acid 1-mercaptopropane-2-yl ester
| Molecular Formula | C5H10O2S |
|---|---|
| Molecular Weight | 134.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 134.04015 |
| Heavy Atoms | 8 |
| Complexity | 82.0 |
Chemical Identifiers
| CAS Number | 35508-06-6 |
|---|---|
| SMILES | CC(CS)OC(=O)C |
| InChIKey | QQUPXRYKZXSZAM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Mercapto-2-propanol, acetate (CAS 35508-06-6), with molecular formula C5H10O2S and molecular weight 134.04 g/mol. IUPAC: 1-sulfanylpropan-2-yl acetate.
Chemical Property Profile of 1-Mercapto-2-propanol, acetate
Property Insights of 1-Mercapto-2-propanol, acetate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Mercapto-2-propanol, acetate. With a topological polar surface area (TPSA) of 27.3 Ų, 1-Mercapto-2-propanol, acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Mercapto-2-propanol, acetate has 1 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 1-Mercapto-2-propanol, acetate?
The CAS number of 1-Mercapto-2-propanol, acetate is 35508-06-6.
What is the molecular formula of 1-Mercapto-2-propanol, acetate?
The molecular formula of 1-Mercapto-2-propanol, acetate is C5H10O2S.
What is the molecular weight of 1-Mercapto-2-propanol, acetate?
The molecular weight of 1-Mercapto-2-propanol, acetate is 134.04 g/mol.
Where can I buy 1-Mercapto-2-propanol, acetate?
You can request a quote for 1-Mercapto-2-propanol, acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Mercapto-2-propanol, acetate?
Yes, KEHONG BIO provides custom synthesis services for 1-Mercapto-2-propanol, acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.