| CAS Number | 195140-88-6 |
| Catalog Number | AG018H5N(AGN-PC-02MTSB) |
| Chemical Name | (6-Isopropoxypyridin-3-yl)methanamine |
| IUPAC Name | (6-propan-2-yloxypyridin-3-yl)methanamine |
| InChI | InChI=1S/C9H14N2O/c1-7(2)12-9-4-3-8(5-10)6-11-9/h3-4,6-7H,5,10H2,1-2H3 |
| InChI Key | ZAXOTNRUSOIDKV-UHFFFAOYSA-N |
| MDL Number | MFCD09808644 |
| Molecular Formula | C9H14N2O |
| Molecular Weight | 166.2203 |
| SMILES | CC(OC1=NC=C(CN)C=C1)C |
| Synonyms | [6-(propan-2-yloxy)pyridin-3-yl]methanamine,
195140-88-6,
(6-isopropoxypyridin-3-yl)methanamine,
[(6-isopropoxypyridin-3-yl)methyl]amine,
AC1Q1QQV,
SCHEMBL3939368,
ZINC19281902,
AKOS000156396,
MCULE-3419849401,
EN300-42185,
L-4352,
F2147-1555,
Z1259087073,
|
| Complexity | 128 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.224g/mol |
| Monoisotopic Mass | 166.111g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number