2-tert-Butoxy-5-(methylsulfanyl)thiophene
TL;DR: 2-tert-Butoxy-5-(methylsulfanyl)thiophene (CAS 91005-16-2) is a chemical compound with molecular formula C9H14OS2 and molecular weight 202.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methylpropan-2-yl)oxy]-5-methylsulfanylthiophene
Also Known As: 2-tert-Butoxy-5-(methylsulfanyl)thiophene, 2-methylsulfanyl-5-tert-butoxy-thiophene, 2-[(2-methylpropan-2-yl)oxy]-5-methylsulfanylthiophene, tert-butyl 5-(methylsulfanyl)thiophen-2-yl ether, RefChem:267067
| Molecular Formula | C9H14OS2 |
|---|---|
| Molecular Weight | 202.05 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.04861 |
| Heavy Atoms | 12 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 91005-16-2 |
|---|---|
| SMILES | CC(C)(C)OC1=CC=C(S1)SC |
| InChIKey | UAIVWRHWFCMNNT-UHFFFAOYSA-N |
Product Overview
2-tert-Butoxy-5-(methylsulfanyl)thiophene (CAS 91005-16-2), with molecular formula C9H14OS2 and molecular weight 202.05 g/mol. IUPAC: 2-[(2-methylpropan-2-yl)oxy]-5-methylsulfanylthiophene.
Chemical Property Profile of 2-tert-Butoxy-5-(methylsulfanyl)thiophene
Property Insights of 2-tert-Butoxy-5-(methylsulfanyl)thiophene
The XLogP value of 3.7 indicates that 2-tert-Butoxy-5-(methylsulfanyl)thiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-tert-Butoxy-5-(methylsulfanyl)thiophene. Following Lipinski's Rule of Five, 2-tert-Butoxy-5-(methylsulfanyl)thiophene has 0 hydrogen bond donor(s) and 3 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 2-tert-Butoxy-5-(methylsulfanyl)thiophene?
The CAS number of 2-tert-Butoxy-5-(methylsulfanyl)thiophene is 91005-16-2.
What is the molecular formula of 2-tert-Butoxy-5-(methylsulfanyl)thiophene?
The molecular formula of 2-tert-Butoxy-5-(methylsulfanyl)thiophene is C9H14OS2.
What is the molecular weight of 2-tert-Butoxy-5-(methylsulfanyl)thiophene?
The molecular weight of 2-tert-Butoxy-5-(methylsulfanyl)thiophene is 202.05 g/mol.
Where can I buy 2-tert-Butoxy-5-(methylsulfanyl)thiophene?
You can request a quote for 2-tert-Butoxy-5-(methylsulfanyl)thiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-tert-Butoxy-5-(methylsulfanyl)thiophene?
Yes, KEHONG BIO provides custom synthesis services for 2-tert-Butoxy-5-(methylsulfanyl)thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.