3-(1-Methyl-1-phenylethyl)thiophene
TL;DR: 3-(1-Methyl-1-phenylethyl)thiophene (CAS 54889-45-1) is a chemical compound with molecular formula C13H14S and molecular weight 202.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-phenylpropan-2-yl)thiophene
Also Known As: 3- THIOPHENE, 3-(1-Methyl-1-phenylethyl)thiophene, 3-(2-phenylpropan-2-yl)thiophene, Thiophene, 3-(1-methyl-1-phenylethyl)-, 3-(1-Methyl-1-phenylethyl)thiophene #
| Molecular Formula | C13H14S |
|---|---|
| Molecular Weight | 202.08 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.08162 |
| Heavy Atoms | 14 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 54889-45-1 |
|---|---|
| SMILES | CC(C)(C1=CC=CC=C1)C2=CSC=C2 |
| InChIKey | VDXKZQUERULALC-UHFFFAOYSA-N |
Product Overview
3-(1-Methyl-1-phenylethyl)thiophene (CAS 54889-45-1), with molecular formula C13H14S and molecular weight 202.08 g/mol. IUPAC: 3-(2-phenylpropan-2-yl)thiophene.
Chemical Property Profile of 3-(1-Methyl-1-phenylethyl)thiophene
Property Insights of 3-(1-Methyl-1-phenylethyl)thiophene
The XLogP value of 4.4 indicates that 3-(1-Methyl-1-phenylethyl)thiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 3-(1-Methyl-1-phenylethyl)thiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Methyl-1-phenylethyl)thiophene 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 3-(1-Methyl-1-phenylethyl)thiophene?
The CAS number of 3-(1-Methyl-1-phenylethyl)thiophene is 54889-45-1.
What is the molecular formula of 3-(1-Methyl-1-phenylethyl)thiophene?
The molecular formula of 3-(1-Methyl-1-phenylethyl)thiophene is C13H14S.
What is the molecular weight of 3-(1-Methyl-1-phenylethyl)thiophene?
The molecular weight of 3-(1-Methyl-1-phenylethyl)thiophene is 202.08 g/mol.
Where can I buy 3-(1-Methyl-1-phenylethyl)thiophene?
You can request a quote for 3-(1-Methyl-1-phenylethyl)thiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-Methyl-1-phenylethyl)thiophene?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Methyl-1-phenylethyl)thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.