1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid
TL;DR: 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid (CAS 55844-80-9) is a chemical compound with molecular formula C18H23ClO4 and molecular weight 338.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid
Also Known As: Ethyl acrylate, vinyl benzyl chloride, methacrylic acid polymer, (C9-H9-Cl.C5-H8-O2.C4-H6-O2)x-, 2-Propenoic acid, 2-methyl-, polymer with (chloromethyl)ethenylbenzene and ethyl 2-propenoate, 1-(chloromethyl)-2-ethenylbenzene; ethyl prop-2-enoate; 2-methylprop-2-enoic acid, 2-Propenoic acid, 2-methyl-, polymer with 2-(chloromethyl)ethenylbenzene and ethyl 2-propenoate
| Molecular Formula | C18H23ClO4 |
|---|---|
| Molecular Weight | 338.13 g/mol |
| LogP | 4.451 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 338.12848 |
| Heavy Atoms | 23 |
| Complexity | 523.57806 |
Chemical Identifiers
| CAS Number | 55844-80-9 |
|---|---|
| SMILES | CCOC(=O)C=C.CC(=C)C(=O)O.C=CC1=CC=CC=C1CCl |
Product Overview
1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid (CAS 55844-80-9), with molecular formula C18H23ClO4 and molecular weight 338.13 g/mol. IUPAC: 1-(chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid.
Chemical Property Profile of 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid
Property Insights of 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid
The XLogP value of 4.451 indicates that 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid. Following Lipinski's Rule of Five, 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic 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 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid?
The CAS number of 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid is 55844-80-9.
What is the molecular formula of 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid?
The molecular formula of 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid is C18H23ClO4.
What is the molecular weight of 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid?
The molecular weight of 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid is 338.13 g/mol.
Where can I buy 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid?
You can request a quote for 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(Chloromethyl)-2-ethenylbenzene;ethyl prop-2-enoate;2-methylprop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.