(E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid
TL;DR: (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid (CAS 372181-03-8) is a chemical compound with molecular formula C16H12N4O7 and molecular weight 372.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3,5-dinitro-2-prop-2-enoxyphenyl)diazenyl]benzoic acid
Also Known As: 4-(3,5-dinitro-2-prop-2-enoxy-phenyl)diazenylbenzoic Acid, (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid, 4-[(3,5-dinitro-2-prop-2-enoxyphenyl)diazenyl]benzoic acid, 4-{(E)-[3,5-dinitro-2-(prop-2-en-1-yloxy)phenyl]diazenyl}benzoic acid
| Molecular Formula | C16H12N4O7 |
|---|---|
| Molecular Weight | 372.07 g/mol |
| LogP | 4.1814 |
| Topological Polar Surface Area | 157.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 372.0706 |
| Heavy Atoms | 27 |
| Complexity | 938.53015 |
Chemical Identifiers
| CAS Number | 372181-03-8 |
|---|---|
| SMILES | C=CCOC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N=NC2=CC=C(C=C2)C(=O)O |
Product Overview
(E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid (CAS 372181-03-8), with molecular formula C16H12N4O7 and molecular weight 372.07 g/mol. IUPAC: 4-[(3,5-dinitro-2-prop-2-enoxyphenyl)diazenyl]benzoic acid.
Chemical Property Profile of (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid
Property Insights of (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid
The XLogP value of 4.1814 indicates that (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 157.53 Ų indicates high polarity, suggesting (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid has 1 hydrogen bond donor(s) and 8 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 (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid?
The CAS number of (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid is 372181-03-8.
What is the molecular formula of (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid?
The molecular formula of (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid is C16H12N4O7.
What is the molecular weight of (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid?
The molecular weight of (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid is 372.07 g/mol.
Where can I buy (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid?
You can request a quote for (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-((2-(allyloxy)-3,5-dinitrophenyl)diazenyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.