Thymol-TMS
TL;DR: Thymol-TMS (CAS 55012-80-1) is a chemical compound with molecular formula C13H22OSi and molecular weight 222.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-(5-methyl-2-propan-2-ylphenoxy)silane
Also Known As: Thymol-TMS, Thymol, TMS derivative, Trimethyl(5-methyl-2-isopropylphenoxy)silane, 2-isopropyl-5-methylphenoxytrimethylsilane, Silane, trimethyl[5-methyl-2-(1-methylethyl)phenoxy]-
| Molecular Formula | C13H22OSi |
|---|---|
| Molecular Weight | 222.14 g/mol |
| LogP | 4.33212 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.144 |
| Heavy Atoms | 15 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 55012-80-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)O[Si](C)(C)C |
| InChIKey | UTGMDFONUNJYQP-UHFFFAOYSA-N |
Product Overview
Thymol-TMS (CAS 55012-80-1), with molecular formula C13H22OSi and molecular weight 222.14 g/mol. IUPAC: trimethyl-(5-methyl-2-propan-2-ylphenoxy)silane.
Chemical Property Profile of Thymol-TMS
Property Insights of Thymol-TMS
The XLogP value of 4.33212 indicates that Thymol-TMS is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Thymol-TMS exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thymol-TMS has 0 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 Thymol-TMS?
The CAS number of Thymol-TMS is 55012-80-1.
What is the molecular formula of Thymol-TMS?
The molecular formula of Thymol-TMS is C13H22OSi.
What is the molecular weight of Thymol-TMS?
The molecular weight of Thymol-TMS is 222.14 g/mol.
Where can I buy Thymol-TMS?
You can request a quote for Thymol-TMS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thymol-TMS?
Yes, KEHONG BIO provides custom synthesis services for Thymol-TMS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.