2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate
TL;DR: 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate (CAS 669757-67-9) is a chemical compound with molecular formula C14H12O3S and molecular weight 260.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-methylphenyl)-2-oxoethyl] thiophene-2-carboxylate
Also Known As: 2-(4-methylphenyl)-2-oxoethyl 2-thiophenecarboxylate, [2-(4-methylphenyl)-2-oxoethyl] thiophene-2-carboxylate, 2-(4-methylphenyl)-2-oxoethyl thiophene-2-carboxylate, thiophene-2-carboxylic acid [2-keto-2-(p-tolyl)ethyl] ester, [2-(4-methylphenyl)-2-oxidanylidene-ethyl] thiophene-2-carboxylate
| Molecular Formula | C14H12O3S |
|---|---|
| Molecular Weight | 260.05 g/mol |
| LogP | 3.09622 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.05072 |
| Heavy Atoms | 18 |
| Complexity | 540.9279 |
Chemical Identifiers
| CAS Number | 669757-67-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CS2 |
Product Overview
2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate (CAS 669757-67-9), with molecular formula C14H12O3S and molecular weight 260.05 g/mol. IUPAC: [2-(4-methylphenyl)-2-oxoethyl] thiophene-2-carboxylate.
Chemical Property Profile of 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate
Property Insights of 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate
The XLogP value of 3.09622 indicates that 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate has 0 hydrogen bond donor(s) and 4 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-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate?
The CAS number of 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate is 669757-67-9.
What is the molecular formula of 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate?
The molecular formula of 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate is C14H12O3S.
What is the molecular weight of 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate?
The molecular weight of 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate is 260.05 g/mol.
Where can I buy 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate?
You can request a quote for 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methylphenyl)-2-oxoethyl 2-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.