| CAS Number | 179873-54-2 |
| Catalog Number | AG01E85O(AGN-PC-0O536P) |
| Chemical Name | [(5-Methoxypyridin-3-yl)methyl](methyl)amine |
| IUPAC Name | 1-(5-methoxypyridin-3-yl)-N-methylmethanamine |
| InChI | InChI=1S/C8H12N2O/c1-9-4-7-3-8(11-2)6-10-5-7/h3,5-6,9H,4H2,1-2H3 |
| InChI Key | UQUCOEHTKOZANI-UHFFFAOYSA-N |
| MDL Number | MFCD13189009 |
| Molecular Formula | C8H12N2O |
| Molecular Weight | 152.1937 |
| SMILES | CNCC1=CC(OC)=CN=C1 |
| Synonyms | 179873-54-2,
1-(5-METHOXYPYRIDIN-3-YL)-N-METHYLMETHANAMINE,
SCHEMBL16942785,
AKOS017517777,
AB67557,
3-Pyridinemethanamine, 5-methoxy-N-methyl-,
[(5-methoxypyridin-3-yl)methyl](methyl)amine,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 152.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.197g/mol |
| Monoisotopic Mass | 152.095g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 34.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
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Certificate of Analysis
Lot Number