| CAS Number | 1265965-97-6 |
| Catalog Number | AG01BAKM(AGN-PC-0WOLU9) |
| Chemical Name | Methyl 6-fluoro-2-oxo-2,3-dihydro-1H-indole-5-carboxylate |
| IUPAC Name | methyl 6-fluoro-2-oxo-1,3-dihydroindole-5-carboxylate |
| InChI | InChI=1S/C10H8FNO3/c1-15-10(14)6-2-5-3-9(13)12-8(5)4-7(6)11/h2,4H,3H2,1H3,(H,12,13) |
| InChI Key | CEUOYELVDHPUAL-UHFFFAOYSA-N |
| MDL Number | MFCD24617111 |
| Molecular Formula | C10H8FNO3 |
| Molecular Weight | 209.1738 |
| SMILES | FC1=C(C=C2CC(NC2=C1)=O)C(=O)OC |
| Synonyms | methyl 6-fluoro-2-oxo-2,3-dihydro-1H-indole-5-carboxylate,
1265965-97-6,
SCHEMBL259844,
CEUOYELVDHPUAL-UHFFFAOYSA-N,
AKOS026617160,
ZINC113422959,
Methyl 6-fluoro-2-oxoindoline-5-carboxylate,
Z2050687930,
methyl6-fluoro-2-oxo-2,3-dihydro-1H-indole-5-carboxylate,
|
| Complexity | 294 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.176g/mol |
| Monoisotopic Mass | 209.049g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number