| CAS Number | 1158322-38-3 |
| Catalog Number | AG00J445(AGN-PC-0WB7WR) |
| Chemical Name | N-(4-Pyridinylmethyl)-1-butanamine hydrochloride |
| IUPAC Name | N-(pyridin-4-ylmethyl)butan-1-amine;hydrochloride |
| InChI | InChI=1S/C10H16N2.ClH/c1-2-3-6-12-9-10-4-7-11-8-5-10;/h4-5,7-8,12H,2-3,6,9H2,1H3;1H |
| InChI Key | FSFLIVHWJJWYJC-UHFFFAOYSA-N |
| MDL Number | MFCD07105391 |
| Molecular Formula | C10H17ClN2 |
| Molecular Weight | 200.7084 |
| SMILES | N1C=CC(CNCCCC)=CC=1.Cl |
| Synonyms | 1158322-38-3,
N-(4-Pyridinylmethyl)-1-butanamine hydrochloride,
N-(Pyridin-4-ylmethyl)butan-1-amine hydrochloride,
SCHEMBL2710961,
KS-00001LIZ,
ZX-CM018407,
MFCD07105391,
AKOS027442159,
MCULE-4427306390,
butyl[(pyridin-4-yl)methyl]amine hydrochloride,
|
| Complexity | 98 |
| 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 | 5 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number