2,3-Diphenylmaleonitrile
TL;DR: 2,3-Diphenylmaleonitrile (CAS 2450-56-8) is a chemical compound with molecular formula C16H10N2 and molecular weight 230.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2,3-diphenylbut-2-enedinitrile
Also Known As: diphenylmaleonitrile, Diphenylfumarodinitrile, 2,3-Diphenylmaleonitrile, Fumaronitrile, diphenyl-, trans-Diphenyldicyanoethylene
| Molecular Formula | C16H10N2 |
|---|---|
| Molecular Weight | 230.08 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.0844 |
| Heavy Atoms | 18 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 2450-56-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=C(/C#N)\C2=CC=CC=C2)/C#N |
| InChIKey | VFBJMPNFKOMEEW-NXVVXOECSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Diphenylmaleonitrile (CAS 2450-56-8), with molecular formula C16H10N2 and molecular weight 230.08 g/mol. IUPAC: (Z)-2,3-diphenylbut-2-enedinitrile.
Chemical Property Profile of 2,3-Diphenylmaleonitrile
Property Insights of 2,3-Diphenylmaleonitrile
The XLogP value of 3.2 indicates that 2,3-Diphenylmaleonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, 2,3-Diphenylmaleonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Diphenylmaleonitrile 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 2,3-Diphenylmaleonitrile?
The CAS number of 2,3-Diphenylmaleonitrile is 2450-56-8.
What is the molecular formula of 2,3-Diphenylmaleonitrile?
The molecular formula of 2,3-Diphenylmaleonitrile is C16H10N2.
What is the molecular weight of 2,3-Diphenylmaleonitrile?
The molecular weight of 2,3-Diphenylmaleonitrile is 230.08 g/mol.
Where can I buy 2,3-Diphenylmaleonitrile?
You can request a quote for 2,3-Diphenylmaleonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Diphenylmaleonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Diphenylmaleonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.