Ethanethiol, 2-propylamino-
TL;DR: Ethanethiol, 2-propylamino- (CAS 5891-07-6) is a chemical compound with molecular formula C5H13NS and molecular weight 119.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(propylamino)ethanethiol
Also Known As: 2-Propylaminoethanethiol, Ethanethiol, 2-propylamino-, 2-(propylamino)ethanethiol, 2-propylamino-ethanethiol, 2-(propylamino)ethane-1-thiol
| Molecular Formula | C5H13NS |
|---|---|
| Molecular Weight | 119.08 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 13.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 119.07687 |
| Heavy Atoms | 7 |
| Complexity | 31.0 |
Chemical Identifiers
| CAS Number | 5891-07-6 |
|---|---|
| SMILES | CCCNCCS |
| InChIKey | RVHUIQSWHPZCCP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanethiol, 2-propylamino- (CAS 5891-07-6), with molecular formula C5H13NS and molecular weight 119.08 g/mol. IUPAC: 2-(propylamino)ethanethiol.
Chemical Property Profile of Ethanethiol, 2-propylamino-
Property Insights of Ethanethiol, 2-propylamino-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanethiol, 2-propylamino-. With a topological polar surface area (TPSA) of 13.0 Ų, Ethanethiol, 2-propylamino- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanethiol, 2-propylamino- has 2 hydrogen bond donor(s) and 2 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 Ethanethiol, 2-propylamino-?
The CAS number of Ethanethiol, 2-propylamino- is 5891-07-6.
What is the molecular formula of Ethanethiol, 2-propylamino-?
The molecular formula of Ethanethiol, 2-propylamino- is C5H13NS.
What is the molecular weight of Ethanethiol, 2-propylamino-?
The molecular weight of Ethanethiol, 2-propylamino- is 119.08 g/mol.
Where can I buy Ethanethiol, 2-propylamino-?
You can request a quote for Ethanethiol, 2-propylamino- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanethiol, 2-propylamino-?
Yes, KEHONG BIO provides custom synthesis services for Ethanethiol, 2-propylamino- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.