2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester
TL;DR: 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester (CAS 57322-59-5) is a chemical compound with molecular formula C11H15ClO4 and molecular weight 246.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-chloro-2-(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate
Also Known As: 3-Chloro-1,2-propanediol dimethacrylate, 3-Chloro-1,2-propanediol, dimethacrylate, 1-(Chloromethyl)-1,2-ethanediyl bismethacrylate, 3-Chloro-1,2-bis(methacryloyloxy)propane, 3-Chloropropane-1,2-diyl bis(2-methylacrylate)
| Molecular Formula | C11H15ClO4 |
|---|---|
| Molecular Weight | 246.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 246.06589 |
| Heavy Atoms | 16 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 57322-59-5 |
|---|---|
| SMILES | CC(=C)C(=O)OCC(CCl)OC(=O)C(=C)C |
| InChIKey | QGDHNMDUMGMVAO-UHFFFAOYSA-N |
Product Overview
2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester (CAS 57322-59-5), with molecular formula C11H15ClO4 and molecular weight 246.07 g/mol. IUPAC: [3-chloro-2-(2-methylprop-2-enoyloxy)propyl] 2-methylprop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester
Property Insights of 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester 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-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester?
The CAS number of 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester is 57322-59-5.
What is the molecular formula of 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester?
The molecular formula of 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester is C11H15ClO4.
What is the molecular weight of 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester?
The molecular weight of 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester is 246.07 g/mol.
Where can I buy 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester?
You can request a quote for 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 2-methyl-, 1,1'-(1-(chloromethyl)-1,2-ethanediyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.