2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile
TL;DR: 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile (CAS 848-79-3) is a chemical compound with molecular formula C18H11ClN2O and molecular weight 306.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile
Also Known As: .delta.(sup 1(4H),.alpha.)-Naphthaleneacetonitrile, .alpha.-(p-chlorophe, 2-(4-chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile
| Molecular Formula | C18H11ClN2O |
|---|---|
| Molecular Weight | 306.06 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 56.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 306.056 |
| Heavy Atoms | 22 |
| Complexity | 561.0 |
Chemical Identifiers
| CAS Number | 848-79-3 |
|---|---|
| SMILES | C1=CC=C2C(=NO)C=CC(=C(C#N)C3=CC=C(C=C3)Cl)C2=C1 |
| InChIKey | DGDRKPDZPJGAOV-UHFFFAOYSA-N |
Product Overview
2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile (CAS 848-79-3), with molecular formula C18H11ClN2O and molecular weight 306.06 g/mol. IUPAC: 2-(4-chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile.
Chemical Property Profile of 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile
Property Insights of 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile
The XLogP value of 4.2 indicates that 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.4 Ų, 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile 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 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile?
The CAS number of 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile is 848-79-3.
What is the molecular formula of 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile?
The molecular formula of 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile is C18H11ClN2O.
What is the molecular weight of 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile?
The molecular weight of 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile is 306.06 g/mol.
Where can I buy 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile?
You can request a quote for 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chlorophenyl)-2-(4-hydroxyiminonaphthalen-1-ylidene)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.