| CAS Number | 503176-43-0 |
| Catalog Number | AG00DFXN(AGN-PC-03U1AQ) |
| Chemical Name | 1-(Pyrazin-2-yl)-1H-imidazole-4-carbaldehyde |
| IUPAC Name | 1-pyrazin-2-ylpyrazole-4-carbaldehyde |
| InChI | InChI=1S/C8H6N4O/c13-6-7-3-11-12(5-7)8-4-9-1-2-10-8/h1-6H |
| InChI Key | NNNVETIORKXOFC-UHFFFAOYSA-N |
| MDL Number | MFCD08669926 |
| Molecular Formula | C8H6N4O |
| Molecular Weight | 174.1594 |
| SMILES | O=CC1=CN(N=C1)C1=NC=CN=C1 |
| Synonyms | 1-(PYRAZIN-2-YL)-1H-PYRAZOLE-4-CARBALDEHYDE,
503176-43-0,
CTK4J2434,
KS-00000LUZ,
DTXSID30698030,
6893AB,
MFCD08669926,
ZINC82703632,
1-pyrazin-2-ylpyrazole-4-carbaldehyde,
AKOS006290772,
DS-6355,
AK113892,
AJ-125530,
ST24037648,
F2147-7848,
C8H6N4O,
1- -1H-pyrazole-4-carbaldehyde,
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| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.163g/mol |
| Monoisotopic Mass | 174.054g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 60.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number