| CAS Number | 1039855-27-0 |
| Catalog Number | AG019V19 |
| Chemical Name | [2-(4-propoxyphenoxy)pyridin-3-yl]methanamine |
| IUPAC Name | [2-(4-propoxyphenoxy)pyridin-3-yl]methanamine |
| InChI | InChI=1S/C15H18N2O2/c1-2-10-18-13-5-7-14(8-6-13)19-15-12(11-16)4-3-9-17-15/h3-9H,2,10-11,16H2,1H3 |
| InChI Key | YKILBLPQBANTJK-UHFFFAOYSA-N |
| MDL Number | MFCD11858081 |
| Molecular Formula | C15H18N2O2 |
| Molecular Weight | 258.3156 |
| SMILES | CCCOC1=CC=C(OC2=C(CN)C=CC=N2)C=C1 |
| Synonyms | [2-(4-propoxyphenoxy)pyridin-3-yl]methanamine,
1039855-27-0,
AC1Q2YGC,
CTK8F2398,
ZINC20473845,
AKOS009260050,
MCULE-7637274778,
NE29518,
EN300-43442,
Z444311676,
|
| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 258.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.321g/mol |
| Monoisotopic Mass | 258.137g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 57.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number