6-Hydroxy-3-oxo-1,2-benzisoxazolin
TL;DR: 6-Hydroxy-3-oxo-1,2-benzisoxazolin (CAS 86004-57-1) is a chemical compound with molecular formula C7H5NO3 and molecular weight 151.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-1,2-benzoxazol-3-one
Also Known As: 3,6-dihydroxyindoxazene, Antibiotic Y-T0678H, 6-Hydroxy-3-oxo-1,2-benzisoxazolin, 6-hydroxy-1,2-benzoxazol-3-one, Y-T0678H
| Molecular Formula | C7H5NO3 |
|---|---|
| Molecular Weight | 151.03 g/mol |
| LogP | 0.8267 |
| Topological Polar Surface Area | 66.23 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 151.02695 |
| Heavy Atoms | 11 |
| Complexity | 440.12756 |
Chemical Identifiers
| CAS Number | 86004-57-1 |
|---|---|
| SMILES | C1=CC2=C(C=C1O)ONC2=O |
Product Overview
6-Hydroxy-3-oxo-1,2-benzisoxazolin (CAS 86004-57-1), with molecular formula C7H5NO3 and molecular weight 151.03 g/mol. IUPAC: 6-hydroxy-1,2-benzoxazol-3-one.
Chemical Property Profile of 6-Hydroxy-3-oxo-1,2-benzisoxazolin
Property Insights of 6-Hydroxy-3-oxo-1,2-benzisoxazolin
The XLogP value of 0.8267 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Hydroxy-3-oxo-1,2-benzisoxazolin. The TPSA of 66.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Hydroxy-3-oxo-1,2-benzisoxazolin. Following Lipinski's Rule of Five, 6-Hydroxy-3-oxo-1,2-benzisoxazolin has 2 hydrogen bond donor(s) and 3 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 6-Hydroxy-3-oxo-1,2-benzisoxazolin?
The CAS number of 6-Hydroxy-3-oxo-1,2-benzisoxazolin is 86004-57-1.
What is the molecular formula of 6-Hydroxy-3-oxo-1,2-benzisoxazolin?
The molecular formula of 6-Hydroxy-3-oxo-1,2-benzisoxazolin is C7H5NO3.
What is the molecular weight of 6-Hydroxy-3-oxo-1,2-benzisoxazolin?
The molecular weight of 6-Hydroxy-3-oxo-1,2-benzisoxazolin is 151.03 g/mol.
Where can I buy 6-Hydroxy-3-oxo-1,2-benzisoxazolin?
You can request a quote for 6-Hydroxy-3-oxo-1,2-benzisoxazolin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hydroxy-3-oxo-1,2-benzisoxazolin?
Yes, KEHONG BIO provides custom synthesis services for 6-Hydroxy-3-oxo-1,2-benzisoxazolin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.