| CAS Number | 1334500-04-7 |
| Catalog Number | AG007NFD(AGN-PC-0BGIIG) |
| Chemical Name | 3-(4-aminopyridin-2-yl)benzaldehyde HCl |
| IUPAC Name | 3-(4-aminopyridin-2-yl)benzaldehyde;hydrochloride |
| InChI | InChI=1S/C12H10N2O.ClH/c13-11-4-5-14-12(7-11)10-3-1-2-9(6-10)8-15;/h1-8H,(H2,13,14);1H |
| InChI Key | PIWWFSDCXGKVOC-UHFFFAOYSA-N |
| MDL Number | MFCD20231490 |
| Molecular Formula | C12H11ClN2O |
| Molecular Weight | 234.6815 |
| SMILES | O=Cc1cccc(c1)c1nccc(c1)N.Cl |
| Synonyms | 3-(4-Aminopyridin-2-yl)benzaldehyde hydrochloride,
1334500-04-7,
3-(4-aminopyridin-2-yl)benzaldehyde HCl,
CTK8B6441,
DTXSID60718558,
ANW-53458,
MFCD19684141,
AKOS015888937,
AX8230629,
TC-142203,
ST24022551,
Z9709,
B-7161,
I01-16332,
3-(4-Aminopyridin-2-yl)benzaldehyde--hydrogen chloride (1/1),
C12H10N2O.HCl,
3-(4-Aminopyridin-2-yl)benzaldehydehydrochloride,
|
| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.683g/mol |
| Monoisotopic Mass | 234.056g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 56A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number