Thiophene, 3-(1,1-dimethylethyl)-2-methoxy-
TL;DR: Thiophene, 3-(1,1-dimethylethyl)-2-methoxy- (CAS 57556-16-8) is a chemical compound with molecular formula C9H14OS and molecular weight 170.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-tert-butyl-2-methoxythiophene
Also Known As: 3-tert-butyl-2-methoxythiophene, Thiophene, 3-(1,1-dimethylethyl)-2-methoxy-, Thiophene,3-(1,1-dimethylethyl)-2-methoxy-
| Molecular Formula | C9H14OS |
|---|---|
| Molecular Weight | 170.08 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 37.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.07654 |
| Heavy Atoms | 11 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 57556-16-8 |
|---|---|
| SMILES | CC(C)(C)C1=C(SC=C1)OC |
| InChIKey | IFYXLTLPCLNMGD-UHFFFAOYSA-N |
Product Overview
Thiophene, 3-(1,1-dimethylethyl)-2-methoxy- (CAS 57556-16-8), with molecular formula C9H14OS and molecular weight 170.08 g/mol. IUPAC: 3-tert-butyl-2-methoxythiophene.
Chemical Property Profile of Thiophene, 3-(1,1-dimethylethyl)-2-methoxy-
Property Insights of Thiophene, 3-(1,1-dimethylethyl)-2-methoxy-
The XLogP value of 3.6 indicates that Thiophene, 3-(1,1-dimethylethyl)-2-methoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.5 Ų, Thiophene, 3-(1,1-dimethylethyl)-2-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiophene, 3-(1,1-dimethylethyl)-2-methoxy- has 0 hydrogen bond donor(s) and 2 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 Thiophene, 3-(1,1-dimethylethyl)-2-methoxy-?
The CAS number of Thiophene, 3-(1,1-dimethylethyl)-2-methoxy- is 57556-16-8.
What is the molecular formula of Thiophene, 3-(1,1-dimethylethyl)-2-methoxy-?
The molecular formula of Thiophene, 3-(1,1-dimethylethyl)-2-methoxy- is C9H14OS.
What is the molecular weight of Thiophene, 3-(1,1-dimethylethyl)-2-methoxy-?
The molecular weight of Thiophene, 3-(1,1-dimethylethyl)-2-methoxy- is 170.08 g/mol.
Where can I buy Thiophene, 3-(1,1-dimethylethyl)-2-methoxy-?
You can request a quote for Thiophene, 3-(1,1-dimethylethyl)-2-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiophene, 3-(1,1-dimethylethyl)-2-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for Thiophene, 3-(1,1-dimethylethyl)-2-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.