(4-Dodecylphenyl)methanethiol
TL;DR: (4-Dodecylphenyl)methanethiol (CAS 20025-91-6) is a chemical compound with molecular formula C19H32S and molecular weight 292.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-dodecylphenyl)methanethiol
Also Known As: (4-dodecylphenyl)methanethiol, 4-Dodecylbenzenemethanethiol, J1.592.458F
| Molecular Formula | C19H32S |
|---|---|
| Molecular Weight | 292.22 g/mol |
| LogP | 8.2 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 12 |
| Exact Mass | 292.22247 |
| Heavy Atoms | 20 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 20025-91-6 |
|---|---|
| SMILES | CCCCCCCCCCCCC1=CC=C(C=C1)CS |
| InChIKey | MGHOMBZRLVDFEY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4-Dodecylphenyl)methanethiol (CAS 20025-91-6), with molecular formula C19H32S and molecular weight 292.22 g/mol. IUPAC: (4-dodecylphenyl)methanethiol.
Chemical Property Profile of (4-Dodecylphenyl)methanethiol
Property Insights of (4-Dodecylphenyl)methanethiol
The XLogP value of 8.2 indicates that (4-Dodecylphenyl)methanethiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 1.0 Ų, (4-Dodecylphenyl)methanethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Dodecylphenyl)methanethiol 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 (4-Dodecylphenyl)methanethiol?
The CAS number of (4-Dodecylphenyl)methanethiol is 20025-91-6.
What is the molecular formula of (4-Dodecylphenyl)methanethiol?
The molecular formula of (4-Dodecylphenyl)methanethiol is C19H32S.
What is the molecular weight of (4-Dodecylphenyl)methanethiol?
The molecular weight of (4-Dodecylphenyl)methanethiol is 292.22 g/mol.
Where can I buy (4-Dodecylphenyl)methanethiol?
You can request a quote for (4-Dodecylphenyl)methanethiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Dodecylphenyl)methanethiol?
Yes, KEHONG BIO provides custom synthesis services for (4-Dodecylphenyl)methanethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.