| CAS Number | 1150617-58-5 |
| Catalog Number | AG000FTJ(AGN-PC-0WCTV3) |
| Chemical Name | 5H-Pyrrolo[2,3-b]pyrazine, 2-bromo-7-chloro- |
| IUPAC Name | 2-bromo-7-chloro-5H-pyrrolo[2,3-b]pyrazine |
| InChI | InChI=1S/C6H3BrClN3/c7-4-2-10-6-5(11-4)3(8)1-9-6/h1-2H,(H,9,10) |
| InChI Key | VKBKVPMFSIOUCS-UHFFFAOYSA-N |
| MDL Number | MFCD12031300 |
| Molecular Formula | C6H3BrClN3 |
| Molecular Weight | 232.4651 |
| SMILES | ClC1=CNC2=NC=C(Br)N=C21 |
| Synonyms | 2-bromo-7-chloro-5H-pyrrolo[2,3-b]pyrazine,
1150617-58-5,
SCHEMBL2377045,
VKBKVPMFSIOUCS-UHFFFAOYSA-N,
ZINC32915122,
AKOS015918888,
DS-9054,
FCH1409581,
AX8271285,
2-bromo-7-chloro-5H-pyrrolo[3,2-b]pyrazine,
S14-0076,
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| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.91989g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.46g/mol |
| Monoisotopic Mass | 230.91989g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 41.6Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
Lot Number