| CAS Number | 1350362-43-4 |
| Catalog Number | AG00HTUH(AGN-PC-0WD8F5) |
| Chemical Name | 6-(aminomethyl)pyridine-3-carbonitriledihydrochloride |
| IUPAC Name | 6-(aminomethyl)pyridine-3-carbonitrile;dihydrochloride |
| InChI | InChI=1S/C7H7N3.2ClH/c8-3-6-1-2-7(4-9)10-5-6;;/h1-2,5H,4,9H2;2*1H |
| InChI Key | SWLHCVDQOMSOAV-UHFFFAOYSA-N |
| MDL Number | MFCD30471639 |
| Molecular Formula | C7H9Cl2N3 |
| Molecular Weight | 206.0725 |
| SMILES | N#CC1=CC=C(CN)N=C1.[H]Cl.[H]Cl |
| Synonyms | 1350362-43-4,
6-(aminomethyl)pyridine-3-carbonitrile dihydrochloride,
6-(aminomethyl)nicotinonitrile dihydrochloride,
6-(aminomethyl)pyridine-3-carbonitriledihydrochloride,
SCHEMBL20447683,
MFCD30471639,
AKOS030238282,
KS-0000053F,
AS-53148,
6-(aminomethyl)pyridine-3-carbonitrile 2hcl,
6-Aminomethyl-nicotinonitrile dihydrochloride,
CS-0050389,
6-(Aminomethyl)pyridine-3-carbonitrile diHCl,
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| Complexity | 146 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.07g/mol |
| Monoisotopic Mass | 205.017g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 62.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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