| CAS Number | 939755-82-5 |
| Catalog Number | AG01AKAM |
| Chemical Name | N-[(4-methoxyphenyl)methyl]pyridin-4-amine |
| IUPAC Name | N-[(4-methoxyphenyl)methyl]pyridin-4-amine |
| InChI | InChI=1S/C13H14N2O/c1-16-13-4-2-11(3-5-13)10-15-12-6-8-14-9-7-12/h2-9H,10H2,1H3,(H,14,15) |
| InChI Key | VSFHPHBWZGFZAS-UHFFFAOYSA-N |
| MDL Number | MFCD09026328 |
| Molecular Formula | C13H14N2O |
| Molecular Weight | 214.2631 |
| SMILES | COC1=CC=C(CNC2=CC=NC=C2)C=C1 |
| Synonyms | N-[(4-methoxyphenyl)methyl]pyridin-4-amine,
939755-82-5,
ZINC8699361,
AKOS009227065,
MCULE-8301874642,
NE34484,
EN300-83263,
Z1250132708,
(4-Methoxy-benzyl)-pyridin-4-yl-amine 2HCl salt,
|
| Complexity | 184 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.268g/mol |
| Monoisotopic Mass | 214.111g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 34.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number