4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile
TL;DR: 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile (CAS 62584-65-0) is a chemical compound with molecular formula C20H13NO and molecular weight 283.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile
Also Known As: 4-(3-naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile, 4-[3-(naphthalen-2-yl)-3-oxoprop-1-en-1-yl]benzonitrile, Benzonitrile, 4-[3-(2-naphthalenyl)-3-oxo-1-propenyl]-
| Molecular Formula | C20H13NO |
|---|---|
| Molecular Weight | 283.10 g/mol |
| LogP | 4.60758 |
| Topological Polar Surface Area | 40.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.0997 |
| Heavy Atoms | 22 |
| Complexity | 898.8886 |
Chemical Identifiers
| CAS Number | 62584-65-0 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)C(=O)C=CC3=CC=C(C=C3)C#N |
Product Overview
4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile (CAS 62584-65-0), with molecular formula C20H13NO and molecular weight 283.10 g/mol. IUPAC: 4-(3-naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile.
Chemical Property Profile of 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile
Property Insights of 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile
The XLogP value of 4.60758 indicates that 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.86 Ų, 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile 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 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile?
The CAS number of 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile is 62584-65-0.
What is the molecular formula of 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile?
The molecular formula of 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile is C20H13NO.
What is the molecular weight of 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile?
The molecular weight of 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile is 283.10 g/mol.
Where can I buy 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile?
You can request a quote for 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Naphthalen-2-yl-3-oxoprop-1-enyl)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.