| CAS Number | 1423028-00-5 |
| Catalog Number | AG01A3LC(AGN-PC-0WOQL8) |
| Chemical Name | 1,2,3,6-Tetrahydropyridine-4-carbonitrile hydrochloride |
| IUPAC Name | 1,2,3,6-tetrahydropyridine-4-carbonitrile;hydrochloride |
| InChI | InChI=1S/C6H8N2.ClH/c7-5-6-1-3-8-4-2-6;/h1,8H,2-4H2;1H |
| InChI Key | HOAOYNOEWCAMSH-UHFFFAOYSA-N |
| MDL Number | MFCD22741307 |
| Molecular Formula | C6H9ClN2 |
| Molecular Weight | 144.6021 |
| SMILES | Cl.N1CCC(=CC1)C#N |
| Synonyms | 1,2,3,6-tetrahydropyridine-4-carbonitrile hydrochloride,
1423028-00-5,
AKOS026741132,
NE17032,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.602g/mol |
| Monoisotopic Mass | 144.045g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 35.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number