(6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid
TL;DR: (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid (CAS 100219-71-4) is a chemical compound with molecular formula C9H6BrNO4 and molecular weight 270.94803 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(6-bromo-2-oxo-1,3-benzoxazol-3-yl)acetic acid
Also Known As: (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid, 3(2H)-Benzoxazoleacetic acid, 6-bromo-2-oxo-, 2-(6-bromo-2-oxo-1,3-benzoxazol-3-yl)acetic acid, 2-(6-bromo-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetic acid, 2-(6-Bromo-2-oxobenzo[d]oxazol-3(2H)-yl)acetic acid
Technical Specifications
| Molecular Formula | C9H6BrNO4 |
| Molecular Weight | 270.94803 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.94803 Da |
| Heavy Atoms | 15 |
| Complexity | 296.0 |
| SMILES | C1=CC2=C(C=C1Br)OC(=O)N2CC(=O)O |
| InChIKey | SQNUVNXWEMZEKN-UHFFFAOYSA-N |
Product Description
Applications: (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
(6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid (CAS 100219-71-4) is a fine chemical with the molecular formula C9H6BrNO4 and a molecular weight of 270.95 g/mol. Synonyms include (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid and 3(2H)-Benzoxazoleacetic acid, 6-bromo-2-oxo-.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid
Property Insights of (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid. Following Lipinski's Rule of Five, (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid 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
What is the CAS number of (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid?
The CAS number of (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid is 100219-71-4.
What is the molecular formula of (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid?
The molecular formula of (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid is C9H6BrNO4.
What is the molecular weight of (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid?
The molecular weight of (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid is 270.94803 g/mol.
What are the applications of (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid?
(6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical...
Where can I buy (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid?
You can request a quote for (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid?
Yes, CoreyChem provides custom synthesis services for (6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.