| CAS Number | 356783-24-9 |
| Catalog Number | AG01DHS3 |
| Chemical Name | (E)-N'-(5-bromo-3-cyanopyrazin-2-yl)-N,N-dimethylmethanimidamide |
| IUPAC Name | N'-(5-bromo-3-cyanopyrazin-2-yl)-N,N-dimethylmethanimidamide |
| InChI | InChI=1S/C8H8BrN5/c1-14(2)5-12-8-6(3-10)13-7(9)4-11-8/h4-5H,1-2H3 |
| InChI Key | ZPJLEXQQDZICSP-UHFFFAOYSA-N |
| MDL Number | MFCD27938716 |
| Molecular Formula | C8H8BrN5 |
| Molecular Weight | 254.0866 |
| SMILES | CN(C)C=Nc1ncc(Br)nc1C#N |
| Synonyms | 356783-24-9,
(E)-N'-(5-Bromo-3-cyanopyrazin-2-yl)-N,N-dimethylformimidamide,
N-(5-bromo-3-cyanopyrazin-2-yl)-N,N-dimethylformimidamide,
SCHEMBL6375896,
CS-0059679,
N'-(5-Bromo-3-cyanopyrazin-2-yl)-N,N-dimethylformimidamide,
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| Complexity | 256 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.996g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.091g/mol |
| Monoisotopic Mass | 252.996g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 65.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
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