叔十二硫醇
TL;DR: 叔十二硫醇 (CAS 25103-58-6) is a chemical compound with molecular formula C12H26S and molecular weight 202.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
叔十二硫醇
2,3,3,4,4,5-hexamethylhexane-2-thiol
Also Known As: TERT-DODECANETHIOL, tert-Dodecylmercaptan, tert-Dodecylthiol, tert-Dodecyl mercaptan, t-Dodecanethiol
| Molecular Formula | C12H26S |
|---|---|
| Molecular Weight | 202.18 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.17552 |
| Heavy Atoms | 13 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 25103-58-6 |
|---|---|
| SMILES | CC(C)C(C)(C)C(C)(C)C(C)(C)S |
| InChIKey | YAJYJWXEWKRTPO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
叔十二硫醇 (CAS 25103-58-6), with molecular formula C12H26S and molecular weight 202.18 g/mol. IUPAC: 2,3,3,4,4,5-hexamethylhexane-2-thiol.
Chemical Property Profile of 叔十二硫醇
Property Insights of 叔十二硫醇
The XLogP value of 4.8 indicates that 叔十二硫醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 1.0 Ų, 叔十二硫醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 叔十二硫醇 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 叔十二硫醇?
The CAS number of 叔十二硫醇 is 25103-58-6.
What is the molecular formula of 叔十二硫醇?
The molecular formula of 叔十二硫醇 is C12H26S.
What is the molecular weight of 叔十二硫醇?
The molecular weight of 叔十二硫醇 is 202.18 g/mol.
Where can I buy 叔十二硫醇?
You can request a quote for 叔十二硫醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 叔十二硫醇?
Yes, KEHONG BIO provides custom synthesis services for 叔十二硫醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.