| CAS Number | 887206-72-6 |
| Catalog Number | AG01AQZW(AGN-PC-0WCNDF) |
| Chemical Name | 7-bromopyrido[2,3-b]pyrazine-6-carboxylic acid |
| IUPAC Name | 7-bromopyrido[2,3-b]pyrazine-6-carboxylic acid |
| InChI | InChI=1S/C8H4BrN3O2/c9-4-3-5-7(11-2-1-10-5)12-6(4)8(13)14/h1-3H,(H,13,14) |
| InChI Key | GHRJGGQQZPMOHM-UHFFFAOYSA-N |
| MDL Number | MFCD04971945 |
| Molecular Formula | C8H4BrN3O2 |
| Molecular Weight | 254.0403 |
| SMILES | OC(C1=C(Br)C=C2C(N=CC=N2)=N1)=O |
| Synonyms | 7-bromopyrido[2,3-b]pyrazine-6-carboxylic acid,
887206-72-6,
AC1M0HAF,
ZINC2456141,
AKOS002664550,
MCULE-6157943460,
L-3294,
F1926-0026,
CID2050115,
3-bromo-5,7,10-triazabicyclo[4.4.0]deca-2,4,6,8,10-pentaene-4-carboxylic Acid,
|
| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.949g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.043g/mol |
| Monoisotopic Mass | 252.949g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 76A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number