2,4-Dichloro-3-phenylcyclobut-2-en-1-one
TL;DR: 2,4-Dichloro-3-phenylcyclobut-2-en-1-one (CAS 16547-34-5) is a chemical compound with molecular formula C10H6Cl2O and molecular weight 211.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-3-phenylcyclobut-2-en-1-one
Also Known As: 2,4-dichloro-3-phenylcyclobut-2-en-1-one, 2-Cyclobuten-1-one,2,4-dichloro-3-phenyl, 2,4-Dichloro-3-phenyl-2-cyclobutene-1-one, 2-Cyclobuten-1-one,2,4-dichloro-3-phenyl-, 2-Chloro-3-phenyl-4-chloro-2-cyclobuten-1-one
| Molecular Formula | C10H6Cl2O |
|---|---|
| Molecular Weight | 211.98 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 211.97957 |
| Heavy Atoms | 13 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 16547-34-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C(=O)C2Cl)Cl |
| InChIKey | OJXWQUDNDIYHMD-UHFFFAOYSA-N |
Product Overview
2,4-Dichloro-3-phenylcyclobut-2-en-1-one (CAS 16547-34-5), with molecular formula C10H6Cl2O and molecular weight 211.98 g/mol. IUPAC: 2,4-dichloro-3-phenylcyclobut-2-en-1-one.
Chemical Property Profile of 2,4-Dichloro-3-phenylcyclobut-2-en-1-one
Property Insights of 2,4-Dichloro-3-phenylcyclobut-2-en-1-one
The XLogP value of 3.0 indicates that 2,4-Dichloro-3-phenylcyclobut-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2,4-Dichloro-3-phenylcyclobut-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dichloro-3-phenylcyclobut-2-en-1-one 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 2,4-Dichloro-3-phenylcyclobut-2-en-1-one?
The CAS number of 2,4-Dichloro-3-phenylcyclobut-2-en-1-one is 16547-34-5.
What is the molecular formula of 2,4-Dichloro-3-phenylcyclobut-2-en-1-one?
The molecular formula of 2,4-Dichloro-3-phenylcyclobut-2-en-1-one is C10H6Cl2O.
What is the molecular weight of 2,4-Dichloro-3-phenylcyclobut-2-en-1-one?
The molecular weight of 2,4-Dichloro-3-phenylcyclobut-2-en-1-one is 211.98 g/mol.
Where can I buy 2,4-Dichloro-3-phenylcyclobut-2-en-1-one?
You can request a quote for 2,4-Dichloro-3-phenylcyclobut-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dichloro-3-phenylcyclobut-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dichloro-3-phenylcyclobut-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.