3-氯丙硫醇
TL;DR: 3-氯丙硫醇 (CAS 17481-19-5) is a chemical compound with molecular formula C3H7ClS and molecular weight 110.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-氯丙硫醇
3-chloropropane-1-thiol
Also Known As: 3-Chloro-1-propanethiol, 3-chloropropane-1-thiol, 3-Chloropropanethiol, 1-Propanethiol, 3-chloro-, 3-Chloro Propane Thiol
| Molecular Formula | C3H7ClS |
|---|---|
| Molecular Weight | 110.00 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 109.9957 |
| Heavy Atoms | 5 |
| Complexity | 16.0 |
Chemical Identifiers
| CAS Number | 17481-19-5 |
|---|---|
| SMILES | C(CS)CCl |
| InChIKey | TZCFWOHAWRIQGF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-氯丙硫醇 (CAS 17481-19-5), with molecular formula C3H7ClS and molecular weight 110.00 g/mol. IUPAC: 3-chloropropane-1-thiol.
Chemical Property Profile of 3-氯丙硫醇
Property Insights of 3-氯丙硫醇
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-氯丙硫醇. With a topological polar surface area (TPSA) of 1.0 Ų, 3-氯丙硫醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-氯丙硫醇 has 1 hydrogen bond donor(s) and 1 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-氯丙硫醇?
The CAS number of 3-氯丙硫醇 is 17481-19-5.
What is the molecular formula of 3-氯丙硫醇?
The molecular formula of 3-氯丙硫醇 is C3H7ClS.
What is the molecular weight of 3-氯丙硫醇?
The molecular weight of 3-氯丙硫醇 is 110.00 g/mol.
Where can I buy 3-氯丙硫醇?
You can request a quote for 3-氯丙硫醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-氯丙硫醇?
Yes, KEHONG BIO provides custom synthesis services for 3-氯丙硫醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.