3-Bromopropane-1-thiol
TL;DR: 3-Bromopropane-1-thiol (CAS 75694-39-2) is a chemical compound with molecular formula C3H7BrS and molecular weight 153.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromopropane-1-thiol
Also Known As: 3-bromopropane-1-thiol, 1-Propanethiol, 3-bromo-, 3-bromopropane -1-thiol, 860-343-4, RefChem:499375
| Molecular Formula | C3H7BrS |
|---|---|
| Molecular Weight | 153.95 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 153.94518 |
| Heavy Atoms | 5 |
| Complexity | 16.0 |
Chemical Identifiers
| CAS Number | 75694-39-2 |
|---|---|
| SMILES | C(CS)CBr |
| InChIKey | PLMNEJBJFZHNGF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Bromopropane-1-thiol (CAS 75694-39-2), with molecular formula C3H7BrS and molecular weight 153.95 g/mol. IUPAC: 3-bromopropane-1-thiol.
Chemical Property Profile of 3-Bromopropane-1-thiol
Property Insights of 3-Bromopropane-1-thiol
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromopropane-1-thiol. With a topological polar surface area (TPSA) of 1.0 Ų, 3-Bromopropane-1-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromopropane-1-thiol 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-Bromopropane-1-thiol?
The CAS number of 3-Bromopropane-1-thiol is 75694-39-2.
What is the molecular formula of 3-Bromopropane-1-thiol?
The molecular formula of 3-Bromopropane-1-thiol is C3H7BrS.
What is the molecular weight of 3-Bromopropane-1-thiol?
The molecular weight of 3-Bromopropane-1-thiol is 153.95 g/mol.
Where can I buy 3-Bromopropane-1-thiol?
You can request a quote for 3-Bromopropane-1-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromopropane-1-thiol?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromopropane-1-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.