| CAS Number | 35854-35-4 |
| Catalog Number | AG00D2IT(AGN-PC-0JTPKX) |
| Chemical Name | 4-[(4-methoxyphenyl)methyl]pyridine |
| IUPAC Name | 4-[(4-methoxyphenyl)methyl]pyridine |
| InChI | InChI=1S/C13H13NO/c1-15-13-4-2-11(3-5-13)10-12-6-8-14-9-7-12/h2-9H,10H2,1H3 |
| InChI Key | LXXYGGCIOQWSRL-UHFFFAOYSA-N |
| MDL Number | MFCD18968625 |
| Molecular Formula | C13H13NO |
| Molecular Weight | 199.2484 |
| SMILES | COC1=CC=C(CC2=CC=NC=C2)C=C1 |
| Synonyms | 4-(p-Methoxybenzyl)pyridine,
35854-35-4,
AC1LCWIL,
Pyridine, 4-[(4-methoxyphenyl)methyl]-,
4-(4-Methoxybenzyl)pyridine,
4-(4-Methoxybenzyl)pyridine #,
LXXYGGCIOQWSRL-UHFFFAOYSA-N,
4-[(4-methoxyphenyl)methyl]pyridine,
ZINC32234391,
4- PYRIDINE,
CID607964,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.253g/mol |
| Monoisotopic Mass | 199.1g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number