1-Nonanethiol
TL;DR: 1-Nonanethiol (CAS 1455-21-6) is a chemical compound with molecular formula C9H20S and molecular weight 160.12857 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
nonane-1-thiol
Also Known As: 1-NONANETHIOL, Nonyl mercaptan, nonane-1-thiol, Nonylthiol, n-Nonyl mercaptan
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H20S |
| Molecular Weight | 160.12857 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 160.12857 Da |
| Heavy Atoms | 10 |
| Complexity | 52.0 |
| Melting Point | -20 °C |
| Boiling Point | 220 °C |
| Density | Relative density (water = 1): 0.84 |
| Flash Point | 78 °C |
| Vapor Pressure | 0.13 [mmHg] |
| Solubility | Insoluble (NIOSH, 2024) |
| SMILES | CCCCCCCCCS |
| InChIKey | ZVEZMVFBMOOHAT-UHFFFAOYSA-N |
Chemical Property Profile of 1-Nonanethiol
Property Insights of 1-Nonanethiol
The XLogP value of 5.2 indicates that 1-Nonanethiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 1.0 Ų, 1-Nonanethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Nonanethiol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-Nonanethiol?
The CAS number of 1-Nonanethiol is 1455-21-6.
What is the molecular formula of 1-Nonanethiol?
The molecular formula of 1-Nonanethiol is C9H20S.
What is the molecular weight of 1-Nonanethiol?
The molecular weight of 1-Nonanethiol is 160.12857 g/mol.
Where can I buy 1-Nonanethiol?
You can request a quote for 1-Nonanethiol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Nonanethiol?
Yes, CoreyChem provides custom synthesis services for 1-Nonanethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.