![4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile structure](/static/products/3308/33084-01-4.webp)
4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile
TL;DR: 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile (CAS 33084-01-4) is a chemical compound with molecular formula C23H17NO2 and molecular weight 339.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(4-phenylmethoxyphenyl)prop-2-enoyl]benzonitrile
Also Known As: 4-Benzyloxy-4'-cyan-chalkon, 4-[3-(4-phenylmethoxyphenyl)prop-2-enoyl]benzonitrile, 4-{3-[4-(BENZYLOXY)PHENYL]PROP-2-ENOYL}BENZONITRILE
| Molecular Formula | C23H17NO2 |
|---|---|
| Molecular Weight | 339.13 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 50.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 339.12592 |
| Heavy Atoms | 26 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 33084-01-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)C=CC(=O)C3=CC=C(C=C3)C#N |
| InChIKey | FKMBGHGEEKGDHP-UHFFFAOYSA-N |
Product Overview
4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile (CAS 33084-01-4), with molecular formula C23H17NO2 and molecular weight 339.13 g/mol. IUPAC: 4-[3-(4-phenylmethoxyphenyl)prop-2-enoyl]benzonitrile.
Chemical Property Profile of 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile
Property Insights of 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile
The XLogP value of 4.9 indicates that 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.1 Ų, 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile 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 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile?
The CAS number of 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile is 33084-01-4.
What is the molecular formula of 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile?
The molecular formula of 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile is C23H17NO2.
What is the molecular weight of 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile?
The molecular weight of 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile is 339.13 g/mol.
Where can I buy 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile?
You can request a quote for 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]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-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[3-(4-Phenylmethoxyphenyl)prop-2-enoyl]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.