Acrylic acid, 3-chloroallyl ester
TL;DR: Acrylic acid, 3-chloroallyl ester (CAS 6288-10-4) is a chemical compound with molecular formula C6H7ClO2 and molecular weight 146.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloroprop-2-enyl prop-2-enoate
Also Known As: Acrylic acid, 3-chloroallyl ester, 3-chloroprop-2-enyl prop-2-enoate, 3-chloroprop-2-en-1-yl prop-2-enoate, [(Z)-3-chloroprop-2-enyl] prop-2-enoate, 2-Propenoic acid, 3-chloro-2-propenyl ester
| Molecular Formula | C6H7ClO2 |
|---|---|
| Molecular Weight | 146.01 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 146.01346 |
| Heavy Atoms | 9 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 6288-10-4 |
|---|---|
| SMILES | C=CC(=O)OCC=CCl |
| InChIKey | LKICIQCLJNAOGC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acrylic acid, 3-chloroallyl ester (CAS 6288-10-4), with molecular formula C6H7ClO2 and molecular weight 146.01 g/mol. IUPAC: 3-chloroprop-2-enyl prop-2-enoate.
Chemical Property Profile of Acrylic acid, 3-chloroallyl ester
Property Insights of Acrylic acid, 3-chloroallyl ester
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acrylic acid, 3-chloroallyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Acrylic acid, 3-chloroallyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acrylic acid, 3-chloroallyl ester has 0 hydrogen bond donor(s) and 2 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 Acrylic acid, 3-chloroallyl ester?
The CAS number of Acrylic acid, 3-chloroallyl ester is 6288-10-4.
What is the molecular formula of Acrylic acid, 3-chloroallyl ester?
The molecular formula of Acrylic acid, 3-chloroallyl ester is C6H7ClO2.
What is the molecular weight of Acrylic acid, 3-chloroallyl ester?
The molecular weight of Acrylic acid, 3-chloroallyl ester is 146.01 g/mol.
Where can I buy Acrylic acid, 3-chloroallyl ester?
You can request a quote for Acrylic acid, 3-chloroallyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acrylic acid, 3-chloroallyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acrylic acid, 3-chloroallyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.