![{[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile structure](/static/products/548/54885-17-5.png)
{[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile
TL;DR: {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile (CAS 54885-17-5) is a chemical compound with molecular formula C14H7ClN2O and molecular weight 254.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-chlorophenyl)furan-2-yl]methylidene]propanedinitrile
Also Known As: BAS 01982862, {[5-(4-chlorophenyl)furan-2-yl]methylidene}propanedinitrile, 2-{[5-(4-chlorophenyl)-2-furyl]methylene}malononitrile, 2-[5-(4-Chloro-phenyl)-furan-2-ylmethylene]-malononitrile, 2-[[5-(4-chlorophenyl)furan-2-yl]methylidene]propanedinitrile
| Molecular Formula | C14H7ClN2O |
|---|---|
| Molecular Weight | 254.02 g/mol |
| LogP | 4.03056 |
| Topological Polar Surface Area | 60.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.02469 |
| Heavy Atoms | 18 |
| Complexity | 653.05493 |
Chemical Identifiers
| CAS Number | 54885-17-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC=C(O2)C=C(C#N)C#N)Cl |
Product Overview
{[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile (CAS 54885-17-5), with molecular formula C14H7ClN2O and molecular weight 254.02 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)furan-2-yl]methylidene]propanedinitrile.
Chemical Property Profile of {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile
Property Insights of {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile
The XLogP value of 4.03056 indicates that {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.72 Ų falls within the moderate polarity range, balancing permeability and solubility for {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile. Following Lipinski's Rule of Five, {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile has 0 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 {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile?
The CAS number of {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile is 54885-17-5.
What is the molecular formula of {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile?
The molecular formula of {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile is C14H7ClN2O.
What is the molecular weight of {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile?
The molecular weight of {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile is 254.02 g/mol.
Where can I buy {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile?
You can request a quote for {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for {[5-(4-Chlorophenyl)furan-2-yl]methylidene}propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.