2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo-
TL;DR: 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo- (CAS 171368-63-1) is a chemical compound with molecular formula C12H11NO4 and molecular weight 233.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-aminophenyl)-6-hydroxy-2-oxohexa-3,5-dienoic acid
Also Known As: 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo-, 6-(2-aminophenyl)-6-hydroxy-2-oxohexa-3,5-dienoic acid, (2E,4E)-6-(2-aminophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid
| Molecular Formula | C12H11NO4 |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.0688 |
| Heavy Atoms | 17 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 171368-63-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=CC=CC(=O)C(=O)O)O)N |
| InChIKey | OHOFWYOLTJXLET-UHFFFAOYSA-N |
Product Overview
2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo- (CAS 171368-63-1), with molecular formula C12H11NO4 and molecular weight 233.07 g/mol. IUPAC: 6-(2-aminophenyl)-6-hydroxy-2-oxohexa-3,5-dienoic acid.
Chemical Property Profile of 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo-
Property Insights of 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo-. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo-. Following Lipinski's Rule of Five, 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo- has 3 hydrogen bond donor(s) and 5 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 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo-?
The CAS number of 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo- is 171368-63-1.
What is the molecular formula of 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo-?
The molecular formula of 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo- is C12H11NO4.
What is the molecular weight of 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo-?
The molecular weight of 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo- is 233.07 g/mol.
Where can I buy 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo-?
You can request a quote for 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo-?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Hexadienoic acid, 6-(2-aminophenyl)-2-hydroxy-6-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.