| CAS Number | 926204-84-4 |
| Catalog Number | AG019UPU(AGN-PC-0WNLFH) |
| Chemical Name | [6-(AZEPAN-1-YL)PYRIDIN-3-YL]METHANAMINE |
| IUPAC Name | [6-(azepan-1-yl)pyridin-3-yl]methanamine |
| InChI | InChI=1S/C12H19N3/c13-9-11-5-6-12(14-10-11)15-7-3-1-2-4-8-15/h5-6,10H,1-4,7-9,13H2 |
| InChI Key | VAYROBVVUDIZIS-UHFFFAOYSA-N |
| MDL Number | MFCD09045371 |
| Molecular Formula | C12H19N3 |
| Molecular Weight | 205.2994 |
| SMILES | N1(CCCCCC1)C1=CC=C(C=N1)CN |
| Synonyms | [6-(1-Azepanyl)-3-pyridinyl]methanamine,
[6-(azepan-1-yl)pyridin-3-yl]methanamine,
926204-84-4,
(6-(Azepan-1-yl)pyridin-3-yl)methanamine,
AC1Q542I,
CTK7E5158,
3391AF,
ZINC21961631,
AKOS000129251,
MCULE-7964480129,
NE14171,
[6-(azepan-1-yl)-3-pyridyl]methanamine,
TR-068900,
EN300-42449,
(6-AZEPAN-1-YLPYRIDIN-3-YL)METHYLAMINE,
C12H19N3,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.305g/mol |
| Monoisotopic Mass | 205.158g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number