Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate
TL;DR: Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate (CAS 40160-35-8) is a chemical compound with molecular formula C9H6ClNaO2 and molecular weight 204.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate
Also Known As: sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate, sodium;3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate, sodium 3-(4-chloro-phenyl)-3-oxo-propen-1-olate, Sodium 3-(4-chlorophenyl)-3-oxo-prop-1-en-1-olate, sodium;3-(4-chlorophenyl)-3-oxo-prop-1-en-1-olate
| Molecular Formula | C9H6ClNaO2 |
|---|---|
| Molecular Weight | 204.00 g/mol |
| LogP | -1.5993 |
| Topological Polar Surface Area | 40.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.9954 |
| Heavy Atoms | 13 |
| Complexity | 305.89566 |
Chemical Identifiers
| CAS Number | 40160-35-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)C=C[O-])Cl.[Na+] |
Product Overview
Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate (CAS 40160-35-8), with molecular formula C9H6ClNaO2 and molecular weight 204.00 g/mol. IUPAC: sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate.
Chemical Property Profile of Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate
Property Insights of Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate
The XLogP value of -1.5993 indicates that Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.13 Ų, Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate 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 Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate?
The CAS number of Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate is 40160-35-8.
What is the molecular formula of Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate?
The molecular formula of Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate is C9H6ClNaO2.
What is the molecular weight of Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate?
The molecular weight of Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate is 204.00 g/mol.
Where can I buy Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate?
You can request a quote for Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate?
Yes, KEHONG BIO provides custom synthesis services for Sodium 3-(4-chlorophenyl)-3-oxoprop-1-en-1-olate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.