3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal
TL;DR: 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal (CAS 84682-29-1) is a chemical compound with molecular formula C10H8Cl2O and molecular weight 214.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-3-(4-chlorophenyl)-2-methylprop-2-enal
Also Known As: EINECS 283-592-5, 3-chloro-3-(4-chlorophenyl)-2-methylprop-2-enal, 3-Chloro-3-(4-chlorophenyl)methacrylaldehyde, 3-Chloro-3-(4-chlorophenyl)-2-methyl-2-propenal, 2-Propenal,3-chloro-3-(4-chlorophenyl)-2-methyl-
| Molecular Formula | C10H8Cl2O |
|---|---|
| Molecular Weight | 214.00 g/mol |
| LogP | 3.5087 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.99522 |
| Heavy Atoms | 13 |
| Complexity | 338.4473 |
Chemical Identifiers
| CAS Number | 84682-29-1 |
|---|---|
| SMILES | CC(=C(C1=CC=C(C=C1)Cl)Cl)C=O |
Product Overview
3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal (CAS 84682-29-1), with molecular formula C10H8Cl2O and molecular weight 214.00 g/mol. IUPAC: 3-chloro-3-(4-chlorophenyl)-2-methylprop-2-enal.
Chemical Property Profile of 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal
Property Insights of 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal
The XLogP value of 3.5087 indicates that 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal has 0 hydrogen bond donor(s) and 1 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 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal?
The CAS number of 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal is 84682-29-1.
What is the molecular formula of 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal?
The molecular formula of 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal is C10H8Cl2O.
What is the molecular weight of 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal?
The molecular weight of 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal is 214.00 g/mol.
Where can I buy 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal?
You can request a quote for 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-3-(4-chlorophenyl)-2-methylprop-2-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.