| CAS Number | 1379297-22-9 |
| Catalog Number | AG009E5C(AGN-PC-0WAE1L) |
| Chemical Name | 2-a]pyrazine-8-carboxylate |
| IUPAC Name | methyl 6-bromoimidazo[1,2-a]pyrazine-8-carboxylate |
| InChI | InChI=1S/C8H6BrN3O2/c1-14-8(13)6-7-10-2-3-12(7)4-5(9)11-6/h2-4H,1H3 |
| InChI Key | MDEIINGCHGEFBF-UHFFFAOYSA-N |
| MDL Number | MFCD18793412 |
| Molecular Formula | C8H6BrN3O2 |
| Molecular Weight | 256.0561 |
| SMILES | BrC=1N=C(C=2N(C1)C=CN2)C(=O)OC |
| Synonyms | Methyl 6-bromoimidazo[1,2-a]pyrazine-8-carboxylate,
1379297-22-9,
MFCD18793412,
ZINC66322888,
AKOS025404451,
RP06243,
Y4652,
J-522540,
C8H6BrN3O2,
methyl 6-bromoimidazo[1,2-a]pyrazine-8-carboxylate, 95% - 1G 1g,
908581-18-0,
|
| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.964g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.059g/mol |
| Monoisotopic Mass | 254.964g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 56.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number