3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione
TL;DR: 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione (CAS 10181-98-3) is a chemical compound with molecular formula C8H5NO4 and molecular weight 179.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-1,3-benzoxazine-2,4-dione
Also Known As: 3-hydroxy-1,3-benzoxazine-2,4-dione, 3-hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione, 2H-1,3-Benzoxazine-2,4(3H)-dione,3-hydroxy-, 3-hydroxy-2H-benzo[e][1,3]oxazine-2,4(3H)-dione
| Molecular Formula | C8H5NO4 |
|---|---|
| Molecular Weight | 179.02 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 179.02185 |
| Heavy Atoms | 13 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 10181-98-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C(=O)O2)O |
| InChIKey | PVEQZIQAQALJSB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione (CAS 10181-98-3), with molecular formula C8H5NO4 and molecular weight 179.02 g/mol. IUPAC: 3-hydroxy-1,3-benzoxazine-2,4-dione.
Chemical Property Profile of 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione
Property Insights of 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione. Following Lipinski's Rule of Five, 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione has 1 hydrogen bond donor(s) and 4 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 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione?
The CAS number of 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione is 10181-98-3.
What is the molecular formula of 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione?
The molecular formula of 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione is C8H5NO4.
What is the molecular weight of 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione?
The molecular weight of 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione is 179.02 g/mol.
Where can I buy 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione?
You can request a quote for 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-2h-1,3-benzoxazine-2,4(3h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.