| CAS Number | 620608-78-8 |
| Catalog Number | AG00F995(AGN-PC-016785) |
| Chemical Name | (6-Phenoxypyridin-3-yl)methanamine |
| IUPAC Name | (6-phenoxypyridin-3-yl)methanamine |
| InChI | InChI=1S/C12H12N2O/c13-8-10-6-7-12(14-9-10)15-11-4-2-1-3-5-11/h1-7,9H,8,13H2 |
| InChI Key | UPFYGCWWVXXUFI-UHFFFAOYSA-N |
| MDL Number | MFCD09738654 |
| Molecular Formula | C12H12N2O |
| Molecular Weight | 200.2365 |
| SMILES | NCC1=CN=C(OC2=CC=CC=C2)C=C1 |
| Synonyms | (6-phenoxypyridin-3-yl)methanamine,
620608-78-8,
AC1Q542Q,
SCHEMBL6160873,
CTK7E5174,
3-pyridinemethanamine,6-phenoxy-,
ZINC22221008,
AKOS000148068,
MCULE-1508847478,
3-Pyridinemethanamine,6-phenoxy-(9CI),
(6-PHENOXYPYRIDIN-3-YL)METHYLAMINE,
FT-0717256,
EN300-61877,
Z1262252935,
3-Pyridinemethanamine, 6-phenoxy- (9CI),
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.241g/mol |
| Monoisotopic Mass | 200.095g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number