| CAS Number | 89940-85-2 |
| Catalog Number | AG00IFW5(AGN-PC-0WB6JK) |
| Chemical Name | 3-(Aminomethyl)-1-methyl-2-piperidinone hydrochloride |
| IUPAC Name | 3-(aminomethyl)-1-methylpiperidin-2-one;hydrochloride |
| InChI | InChI=1S/C7H14N2O.ClH/c1-9-4-2-3-6(5-8)7(9)10;/h6H,2-5,8H2,1H3;1H |
| InChI Key | AONVNHVSHAXGMD-UHFFFAOYSA-N |
| MDL Number | MFCD26959485 |
| Molecular Formula | C7H15ClN2O |
| Molecular Weight | 178.6598 |
| SMILES | C1(=O)C(CCCN1C)CN.Cl |
| Synonyms | 89940-85-2,
3-(Aminomethyl)-1-methyl-2-piperidinone hydrochloride,
3-(AMINOMETHYL)-1-METHYLPIPERIDIN-2-ONE HCL,
3-(Aminomethyl)-1-methylpiperidin-2-one hydrochloride,
ZX-CM008874,
MFCD26959485,
AKOS027339387,
AS-42590,
1993105-70-6,
3-(aminomethyl)-1-methylpiperidin-2-one,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.087g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.66g/mol |
| Monoisotopic Mass | 178.087g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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