| CAS Number | 1429903-85-4 |
| Catalog Number | AG01AM9A |
| Chemical Name | 3-bromo-5H,6H,7H-pyrazolo[3,2-b][1,3]oxazine |
| IUPAC Name | 3-bromo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine |
| InChI | InChI=1S/C6H7BrN2O/c7-5-4-8-9-2-1-3-10-6(5)9/h4H,1-3H2 |
| InChI Key | LWKRQSQTGUGFAU-UHFFFAOYSA-N |
| MDL Number | MFCD24038706 |
| Molecular Formula | C6H7BrN2O |
| Molecular Weight | 203.0366 |
| SMILES | BrC=1C=NN2C1OCCC2 |
| Synonyms | 1429903-85-4,
3-Bromo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine,
SCHEMBL19431919,
ZINC95095599,
AKOS023799707,
|
| Complexity | 133 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.974g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.039g/mol |
| Monoisotopic Mass | 201.974g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 27A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number