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Methyl 3-[(4-methylphenyl)sulfonyl]acrylate
TL;DR: Methyl 3-[(4-methylphenyl)sulfonyl]acrylate (CAS 64326-53-0) is a chemical compound with molecular formula C11H12O4S and molecular weight 240.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-3-(4-methylphenyl)sulfonylprop-2-enoate
Also Known As: 3-Tosylacrylic acid methyl ester, methyl 3-[(4-methylphenyl)sulfonyl]acrylate, (E)-3-Tosylacrylic acid methyl ester, J3.292.861G, J3.628.529J
| Molecular Formula | C11H12O4S |
|---|---|
| Molecular Weight | 240.05 g/mol |
| LogP | 1.45542 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.04562 |
| Heavy Atoms | 16 |
| Complexity | 497.29102 |
Chemical Identifiers
| CAS Number | 64326-53-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)/C=C/C(=O)OC |
Product Overview
Methyl 3-[(4-methylphenyl)sulfonyl]acrylate (CAS 64326-53-0), with molecular formula C11H12O4S and molecular weight 240.05 g/mol. IUPAC: methyl (E)-3-(4-methylphenyl)sulfonylprop-2-enoate.
Chemical Property Profile of Methyl 3-[(4-methylphenyl)sulfonyl]acrylate
Property Insights of Methyl 3-[(4-methylphenyl)sulfonyl]acrylate
The XLogP value of 1.45542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-[(4-methylphenyl)sulfonyl]acrylate. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-[(4-methylphenyl)sulfonyl]acrylate. Following Lipinski's Rule of Five, Methyl 3-[(4-methylphenyl)sulfonyl]acrylate 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 Methyl 3-[(4-methylphenyl)sulfonyl]acrylate?
The CAS number of Methyl 3-[(4-methylphenyl)sulfonyl]acrylate is 64326-53-0.
What is the molecular formula of Methyl 3-[(4-methylphenyl)sulfonyl]acrylate?
The molecular formula of Methyl 3-[(4-methylphenyl)sulfonyl]acrylate is C11H12O4S.
What is the molecular weight of Methyl 3-[(4-methylphenyl)sulfonyl]acrylate?
The molecular weight of Methyl 3-[(4-methylphenyl)sulfonyl]acrylate is 240.05 g/mol.
Where can I buy Methyl 3-[(4-methylphenyl)sulfonyl]acrylate?
You can request a quote for Methyl 3-[(4-methylphenyl)sulfonyl]acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-[(4-methylphenyl)sulfonyl]acrylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[(4-methylphenyl)sulfonyl]acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.