| CAS Number | 1378332-54-7 |
| Catalog Number | AG0013WK(AGN-PC-0WD2VU) |
| Chemical Name | 2-Pyrazineacetonitrile, 6-chloro- |
| IUPAC Name | 2-(6-chloropyrazin-2-yl)acetonitrile |
| InChI | InChI=1S/C6H4ClN3/c7-6-4-9-3-5(10-6)1-2-8/h3-4H,1H2 |
| InChI Key | LGKGXAIUFDRFQA-UHFFFAOYSA-N |
| MDL Number | MFCD18909144 |
| Molecular Formula | C6H4ClN3 |
| Molecular Weight | 153.5691 |
| SMILES | C(C#N)C1=NC(=CN=C1)Cl |
| Synonyms | 2-(6-Chloropyrazin-2-yl)acetonitrile,
1378332-54-7,
2-Pyrazineacetonitrile, 6-chloro-,
DTXSID50551759,
(6-Chloropyrazin-2-yl)acetonitrile,
MFCD18909144,
ZINC75540612,
FCH1011865,
AS-43105,
SC-52199,
AJ-121646,
AX8258874,
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| Complexity | 150 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.569g/mol |
| Monoisotopic Mass | 153.009g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number