4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol
TL;DR: 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol (CAS 5306-73-0) is a chemical compound with molecular formula C19H20N2O3 and molecular weight 324.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-2-[[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]phenol
Also Known As: Carbonodithioic acid, O-ethyl ester, mercury(2) salt, Carbonic acid, dithio-, O-ethyl ester, mercury(2) salt, 4-tert-butyl-2-[[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]phenol, 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol
| Molecular Formula | C19H20N2O3 |
|---|---|
| Molecular Weight | 324.15 g/mol |
| LogP | 5.0136 |
| Topological Polar Surface Area | 75.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.1474 |
| Heavy Atoms | 24 |
| Complexity | 802.49945 |
Chemical Identifiers
| CAS Number | 5306-73-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C=C1)O)N=C/C=C/C2=CC=CC=C2[N+](=O)[O-] |
Product Overview
4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol (CAS 5306-73-0), with molecular formula C19H20N2O3 and molecular weight 324.15 g/mol. IUPAC: 4-tert-butyl-2-[[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]phenol.
Chemical Property Profile of 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol
Property Insights of 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol
The XLogP value of 5.0136 indicates that 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol. Following Lipinski's Rule of Five, 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol?
The CAS number of 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol is 5306-73-0.
What is the molecular formula of 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol?
The molecular formula of 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol is C19H20N2O3.
What is the molecular weight of 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol?
The molecular weight of 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol is 324.15 g/mol.
Where can I buy 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol?
You can request a quote for 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-butyl-2-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.