| CAS Number | 926224-73-9 |
| Catalog Number | AG019MNT(AGN-PC-0WC06O) |
| Chemical Name | 4-Methoxy-3-(pyridin-3-ylmethoxy)benzaldehyde |
| IUPAC Name | 4-methoxy-3-(pyridin-3-ylmethoxy)benzaldehyde |
| InChI | InChI=1S/C14H13NO3/c1-17-13-5-4-11(9-16)7-14(13)18-10-12-3-2-6-15-8-12/h2-9H,10H2,1H3 |
| InChI Key | PTCKCSITOQANNI-UHFFFAOYSA-N |
| MDL Number | MFCD08442696 |
| Molecular Formula | C14H13NO3 |
| Molecular Weight | 243.2579 |
| SMILES | COC1=C(OCC2=CN=CC=C2)C=C(C=O)C=C1 |
| Synonyms | 4-methoxy-3-(pyridin-3-ylmethoxy)benzaldehyde,
926224-73-9,
4-METHOXY-3-(PYRIDIN-3-YLMETHOXY)-BENZALDEHYDE,
AC1Q478E,
CTK7H9314,
SBB085437,
ZINC14001378,
AKOS000125686,
MCULE-2652281404,
NE24885,
4-methoxy-3-(3-pyridylmethoxy)benzaldehyde,
TR-056840,
EN300-36747,
|
| Complexity | 259 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.262g/mol |
| Monoisotopic Mass | 243.09g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 48.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number