3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile
TL;DR: 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile (CAS 144782-39-8) is a chemical compound with molecular formula C24H27NO2 and molecular weight 361.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzoyl-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enenitrile
Also Known As: 2-benzoyl-3-(3,5-di-tert-butyl-4-hydroxyphenyl)prop-2-enenitrile, 2-benzoyl-3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-2-enenitrile, 2-benzoyl-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enenitrile, 2-benzoyl-3-(4-hydroxy-3,5-ditert-butyl-phenyl)prop-2-enenitrile, 3-(3,5-BIS(TERT-BUTYL)-4-HYDROXYPHENYL)-2-(PHENYLCARBONYL)PROP-2-ENENITRILE
| Molecular Formula | C24H27NO2 |
|---|---|
| Molecular Weight | 361.20 g/mol |
| LogP | 5.77708 |
| Topological Polar Surface Area | 61.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.2042 |
| Heavy Atoms | 27 |
| Complexity | 882.5743 |
Chemical Identifiers
| CAS Number | 144782-39-8 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C(C#N)C(=O)C2=CC=CC=C2 |
Product Overview
3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile (CAS 144782-39-8), with molecular formula C24H27NO2 and molecular weight 361.20 g/mol. IUPAC: 2-benzoyl-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enenitrile.
Chemical Property Profile of 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile
Property Insights of 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile
The XLogP value of 5.77708 indicates that 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile. Following Lipinski's Rule of Five, 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile?
The CAS number of 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile is 144782-39-8.
What is the molecular formula of 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile?
The molecular formula of 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile is C24H27NO2.
What is the molecular weight of 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile?
The molecular weight of 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile is 361.20 g/mol.
Where can I buy 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile?
You can request a quote for 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,5-Bis(tert-butyl)-4-hydroxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.