3-(Naphthalen-1-yl)-2-phenylacrylonitrile
TL;DR: 3-(Naphthalen-1-yl)-2-phenylacrylonitrile (CAS 65260-38-0) is a chemical compound with molecular formula C19H13N and molecular weight 255.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-naphthalen-1-yl-2-phenylprop-2-enenitrile
Also Known As: TimTec1_001854, 3-(Naphthalen-1-yl)-2-phenylacrylonitrile, 3-naphthalen-1-yl-2-phenylprop-2-enenitrile, Benzeneacetonitrile, a-(1-naphthalenylmethylene)-, (2E)-3-(NAPHTHALEN-1-YL)-2-PHENYLPROP-2-ENENITRILE
| Molecular Formula | C19H13N |
|---|---|
| Molecular Weight | 255.10 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.1048 |
| Heavy Atoms | 20 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 65260-38-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=CC2=CC=CC3=CC=CC=C32)C#N |
| InChIKey | MFTJHPXAPOUGFQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Naphthalen-1-yl)-2-phenylacrylonitrile (CAS 65260-38-0), with molecular formula C19H13N and molecular weight 255.10 g/mol. IUPAC: 3-naphthalen-1-yl-2-phenylprop-2-enenitrile.
Chemical Property Profile of 3-(Naphthalen-1-yl)-2-phenylacrylonitrile
Property Insights of 3-(Naphthalen-1-yl)-2-phenylacrylonitrile
The XLogP value of 5.0 indicates that 3-(Naphthalen-1-yl)-2-phenylacrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, 3-(Naphthalen-1-yl)-2-phenylacrylonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Naphthalen-1-yl)-2-phenylacrylonitrile has 0 hydrogen bond donor(s) and 1 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 3-(Naphthalen-1-yl)-2-phenylacrylonitrile?
The CAS number of 3-(Naphthalen-1-yl)-2-phenylacrylonitrile is 65260-38-0.
What is the molecular formula of 3-(Naphthalen-1-yl)-2-phenylacrylonitrile?
The molecular formula of 3-(Naphthalen-1-yl)-2-phenylacrylonitrile is C19H13N.
What is the molecular weight of 3-(Naphthalen-1-yl)-2-phenylacrylonitrile?
The molecular weight of 3-(Naphthalen-1-yl)-2-phenylacrylonitrile is 255.10 g/mol.
Where can I buy 3-(Naphthalen-1-yl)-2-phenylacrylonitrile?
You can request a quote for 3-(Naphthalen-1-yl)-2-phenylacrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Naphthalen-1-yl)-2-phenylacrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(Naphthalen-1-yl)-2-phenylacrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.