| CAS Number | 1375471-89-8 |
| Catalog Number | AG009K5Z(AGN-PC-0WORSJ) |
| Chemical Name | 5-Aminomethyl-pyridine-2-carboxylic acid methyl ester dihydrochloride |
| IUPAC Name | methyl 5-(aminomethyl)pyridine-2-carboxylate;dihydrochloride |
| InChI | InChI=1S/C8H10N2O2.2ClH/c1-12-8(11)7-3-2-6(4-9)5-10-7;;/h2-3,5H,4,9H2,1H3;2*1H |
| InChI Key | HMQDPWOEGJKCQX-UHFFFAOYSA-N |
| MDL Number | MFCD21602618 |
| Molecular Formula | C8H12Cl2N2O2 |
| Molecular Weight | 239.0991 |
| SMILES | COC(=O)C1=NC=C(C=C1)CN.Cl.Cl |
| Synonyms | 1375471-89-8,
methyl 5-(aminomethyl)pyridine-2-carboxylate dihydrochloride,
methyl 5-(aminomethyl)picolinate dihydrochloride,
5-Aminomethyl-pyridine-2-carboxylic acid methyl ester dihydrochloride,
methyl 5-(aminomethyl)picolinate 2hcl,
SCHEMBL20595343,
MFCD21602618,
AKOS026741987,
AS-37168,
Z-5613,
Z2065616400,
|
| Complexity | 161 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.028g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.096g/mol |
| Monoisotopic Mass | 238.028g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 65.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number