| CAS Number | 1159883-21-2 |
| Catalog Number | AG008V2X |
| Chemical Name | 2-Methyl-3-fluoroanisole |
| IUPAC Name | 1-fluoro-3-methoxy-2-methylbenzene |
| InChI | InChI=1S/C8H9FO/c1-6-7(9)4-3-5-8(6)10-2/h3-5H,1-2H3 |
| InChI Key | OKQSKCBILCDERK-UHFFFAOYSA-N |
| MDL Number | MFCD12922638 |
| Molecular Formula | C8H9FO |
| Molecular Weight | 140.1549 |
| SMILES | c1(cccc(c1C)OC)F |
| Synonyms | 3-Fluoro-2-methylanisole,
1159883-21-2,
1-fluoro-3-methoxy-2-methylbenzene,
2-Fluoro-6-methoxytoluene,
SCHEMBL256786,
ZINC34111854,
AKOS006336171,
FT-0710787,
2-Methyl-3-fluoroanisole,
|
| Complexity | 105 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 140.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 140.157g/mol |
| Monoisotopic Mass | 140.064g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number