| CAS Number | 1311271-24-5 |
| Catalog Number | AG01C5RH |
| Chemical Name | 5-Fluoro-2-hydroxy-4-methoxybenzaldehyde |
| IUPAC Name | 5-fluoro-2-hydroxy-4-methoxybenzaldehyde |
| InChI | InChI=1S/C8H7FO3/c1-12-8-3-7(11)5(4-10)2-6(8)9/h2-4,11H,1H3 |
| InChI Key | RTVJRZMNNIHDFJ-UHFFFAOYSA-N |
| MDL Number | MFCD23705545 |
| Molecular Formula | C8H7FO3 |
| Molecular Weight | 170.1378 |
| SMILES | COC1=C(F)C=C(C=O)C(O)=C1 |
| Synonyms | 5-fluoro-2-hydroxy-4-methoxybenzaldehyde,
1311271-24-5,
Benzaldehyde, 5-fluoro-2-hydroxy-4-methoxy-,
SCHEMBL15349701,
RTVJRZMNNIHDFJ-UHFFFAOYSA-N,
ZINC211756251,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.139g/mol |
| Monoisotopic Mass | 170.038g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number