(2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid
TL;DR: (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid (CAS 5937-84-8) is a chemical compound with molecular formula C10H10O4S and molecular weight 226.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(4-methylsulfonylphenyl)prop-2-enoic acid
Also Known As: (2E)-3-[4-(Methylsulfonyl)phenyl]propenoic acid, 3-(4-(methylsulfonyl)phenyl)acrylic acid, 4-Methylsulfonylcinnamic acid, 4-(Methylsulphonyl)cinnamic acid, (E)-4-methylsulfonylcinnamic acid
| Molecular Formula | C10H10O4S |
|---|---|
| Molecular Weight | 226.03 g/mol |
| LogP | 1.1879 |
| Topological Polar Surface Area | 71.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.02998 |
| Heavy Atoms | 15 |
| Complexity | 482.6586 |
Chemical Identifiers
| CAS Number | 5937-84-8 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)O |
Product Overview
(2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid (CAS 5937-84-8), with molecular formula C10H10O4S and molecular weight 226.03 g/mol. IUPAC: (E)-3-(4-methylsulfonylphenyl)prop-2-enoic acid.
Chemical Property Profile of (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid
Property Insights of (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid
The XLogP value of 1.1879 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid. The TPSA of 71.44 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid. Following Lipinski's Rule of Five, (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid has 1 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 (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid?
The CAS number of (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid is 5937-84-8.
What is the molecular formula of (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid?
The molecular formula of (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid is C10H10O4S.
What is the molecular weight of (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid?
The molecular weight of (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid is 226.03 g/mol.
Where can I buy (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid?
You can request a quote for (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-(4-(Methylsulfonyl)phenyl)propenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.