| CAS Number | 1049678-14-9 |
| Catalog Number | AG00J3ZI |
| Chemical Name | N-(4-pyridinylmethyl)-2-butanamine hydrochloride |
| IUPAC Name | N-(pyridin-4-ylmethyl)butan-2-amine;hydrochloride |
| InChI | InChI=1S/C10H16N2.ClH/c1-3-9(2)12-8-10-4-6-11-7-5-10;/h4-7,9,12H,3,8H2,1-2H3;1H |
| InChI Key | IXLRMVMNVSMNPT-UHFFFAOYSA-N |
| MDL Number | MFCD07107491 |
| Molecular Formula | C10H17ClN2 |
| Molecular Weight | 200.7084 |
| SMILES | N1C=CC(=CC=1)CNC(C)CC.Cl |
| Synonyms | N-(4-Pyridinylmethyl)-2-butanamine hydrochloride,
1049678-14-9,
ZX-CM018057,
MFCD07107491,
MCULE-2477559863,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.71g/mol |
| Monoisotopic Mass | 200.108g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number