| CAS Number | 147359-12-4 |
| Catalog Number | AG01C5SN(AGN-PC-0Q078V) |
| Chemical Name | methyl 2-amino-3,4,5,6-tetrahydropyridine-3-carboxylate hydrochloride |
| IUPAC Name | methyl 6-amino-2,3,4,5-tetrahydropyridine-5-carboxylate;hydrochloride |
| InChI | InChI=1S/C7H12N2O2.ClH/c1-11-7(10)5-3-2-4-9-6(5)8;/h5H,2-4H2,1H3,(H2,8,9);1H |
| InChI Key | FOVYHQCNKBMDAK-UHFFFAOYSA-N |
| MDL Number | MFCD29907107 |
| Molecular Formula | C7H13ClN2O2 |
| Molecular Weight | 192.6433 |
| SMILES | Cl.COC(C1C(N)=NCCC1)=O |
| Synonyms | methyl 2-amino-3,4,5,6-tetrahydropyridine-3-carboxylate hydrochloride,
147359-12-4,
CHEMBL552914,
SCHEMBL1832818,
FOVYHQCNKBMDAK-UHFFFAOYSA-N,
AKOS033920421,
Z2467454589,
2-Amino-3-methoxycarbonyl-3,4,5,6-tetrahvdropyridine HCl,
2-Amino-3-methoxycarbonyl-3,4,5,6-tetrahydropyridine HCl,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 192.643g/mol |
| Monoisotopic Mass | 192.067g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 64.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number