![4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid structure](/static/products/120/1206605-05-1.webp)
4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid
TL;DR: 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid (CAS 1206605-05-1) is a chemical compound with molecular formula C12H11N3O3 and molecular weight 245.08005 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(3,5-dimethyl-1,2-oxazol-4-yl)diazenyl]benzoic acid
Also Known As: BAS 03840800, 4-(3,5-Dimethyl-isoxazol-4-ylazo)-benzoic acid, 4-[(3,5-dimethylisoxazol-4-yl)diazenyl]benzoic acid, (E)-4-((3,5-dimethylisoxazol-4-yl)diazenyl)benzoic acid, 4-[(3,5-dimethyl-1,2-oxazol-4-yl)diazenyl]benzoic acid
Technical Specifications
| Molecular Formula | C12H11N3O3 |
| Molecular Weight | 245.08005 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 88.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.08005 Da |
| Heavy Atoms | 18 |
| Complexity | 327.0 |
| SMILES | CC1=C(C(=NO1)C)N=NC2=CC=C(C=C2)C(=O)O |
| InChIKey | OURHBHSLVNVZAM-UHFFFAOYSA-N |
Chemical Property Profile of 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid
Property Insights of 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid. Following Lipinski's Rule of Five, 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid?
The CAS number of 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid is 1206605-05-1.
What is the molecular formula of 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid?
The molecular formula of 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid is C12H11N3O3.
What is the molecular weight of 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid?
The molecular weight of 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid is 245.08005 g/mol.
Where can I buy 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid?
You can request a quote for 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid?
Yes, CoreyChem provides custom synthesis services for 4-[(3,5-Dimethylisoxazol-4-yl)diazenyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.