tert-Hexadecanethiol
TL;DR: tert-Hexadecanethiol (CAS 25360-09-2) is a chemical compound with molecular formula C16H34S and molecular weight 258.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13,13-dimethyltetradecane-1-thiol
Also Known As: tert-Hexadecanethiol, tert-Hexadecyl mercaptan, t-hexadecanethiol, hexadecylmercaptan, 2-methylpentadecane-2-thiol
| Molecular Formula | C16H34S |
|---|---|
| Molecular Weight | 258.24 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 12 |
| Exact Mass | 258.23813 |
| Heavy Atoms | 17 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 25360-09-2 |
|---|---|
| SMILES | CC(C)(C)CCCCCCCCCCCCS |
| InChIKey | KZIYAWAYDPPPIU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
tert-Hexadecanethiol (CAS 25360-09-2), with molecular formula C16H34S and molecular weight 258.24 g/mol. IUPAC: 13,13-dimethyltetradecane-1-thiol.
Chemical Property Profile of tert-Hexadecanethiol
Property Insights of tert-Hexadecanethiol
The XLogP value of 7.8 indicates that tert-Hexadecanethiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 1.0 Ų, tert-Hexadecanethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Hexadecanethiol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of tert-Hexadecanethiol?
The CAS number of tert-Hexadecanethiol is 25360-09-2.
What is the molecular formula of tert-Hexadecanethiol?
The molecular formula of tert-Hexadecanethiol is C16H34S.
What is the molecular weight of tert-Hexadecanethiol?
The molecular weight of tert-Hexadecanethiol is 258.24 g/mol.
Where can I buy tert-Hexadecanethiol?
You can request a quote for tert-Hexadecanethiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Hexadecanethiol?
Yes, KEHONG BIO provides custom synthesis services for tert-Hexadecanethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.