| CAS Number | 1261634-06-3 |
| Catalog Number | AG009JVJ |
| Chemical Name | 3-Bromopyrazin-2-ol |
| IUPAC Name | 3-bromo-1H-pyrazin-2-one |
| InChI | InChI=1S/C4H3BrN2O/c5-3-4(8)7-2-1-6-3/h1-2H,(H,7,8) |
| InChI Key | FXXVXMZIFSXOMR-UHFFFAOYSA-N |
| MDL Number | MFCD18415489 |
| Molecular Formula | C4H3BrN2O |
| Molecular Weight | 174.9834 |
| SMILES | OC1=NC=CN=C1Br |
| Synonyms | 3-bromopyrazin-2-ol,
1261634-06-3,
3-Bromopyrazin-2(1H)-one,
2-Bromo-3-hydroxypyrazine,
SCHEMBL935566,
DTXSID60623294,
QC-6877,
AK-54918,
AJ-137232,
3-bromo-2(1H)-Pyrazinone,
3042-84-0,
|
| Complexity | 173 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.943g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.985g/mol |
| Monoisotopic Mass | 173.943g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 41.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number