2-Methyl-1-pentanethiol
TL;DR: 2-Methyl-1-pentanethiol (CAS 1633-89-2) is a chemical compound with molecular formula C6H14S and molecular weight 118.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpentane-1-thiol
Also Known As: 2-Methyl-1-pentanethiol, 2-methylpentane-1-thiol, 1-Pentanethiol, 2-methyl-, 2-methyl pentane thiol, 2-Methyl-1-pentanethiol #
| Molecular Formula | C6H14S |
|---|---|
| Molecular Weight | 118.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 118.08162 |
| Heavy Atoms | 7 |
| Complexity | 35.0 |
Chemical Identifiers
| CAS Number | 1633-89-2 |
|---|---|
| SMILES | CCCC(C)CS |
| InChIKey | ZUPLFMMTGJBSMK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-1-pentanethiol (CAS 1633-89-2), with molecular formula C6H14S and molecular weight 118.08 g/mol. IUPAC: 2-methylpentane-1-thiol.
Chemical Property Profile of 2-Methyl-1-pentanethiol
Property Insights of 2-Methyl-1-pentanethiol
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-1-pentanethiol. With a topological polar surface area (TPSA) of 1.0 Ų, 2-Methyl-1-pentanethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-1-pentanethiol 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 2-Methyl-1-pentanethiol?
The CAS number of 2-Methyl-1-pentanethiol is 1633-89-2.
What is the molecular formula of 2-Methyl-1-pentanethiol?
The molecular formula of 2-Methyl-1-pentanethiol is C6H14S.
What is the molecular weight of 2-Methyl-1-pentanethiol?
The molecular weight of 2-Methyl-1-pentanethiol is 118.08 g/mol.
Where can I buy 2-Methyl-1-pentanethiol?
You can request a quote for 2-Methyl-1-pentanethiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1-pentanethiol?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1-pentanethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.