| CAS Number | 953894-64-9 |
| Catalog Number | AG019XGL(AGN-PC-0WO48N) |
| Chemical Name | 5-Chloro-7-fluoro-2,3-dihydro-1H-indole-2,3-dione |
| IUPAC Name | 5-chloro-7-fluoro-1H-indole-2,3-dione |
| InChI | InChI=1S/C8H3ClFNO2/c9-3-1-4-6(5(10)2-3)11-8(13)7(4)12/h1-2H,(H,11,12,13) |
| InChI Key | YXFUMUTYASYEGQ-UHFFFAOYSA-N |
| MDL Number | MFCD09730469 |
| Molecular Formula | C8H3ClFNO2 |
| Molecular Weight | 199.5663 |
| SMILES | FC1=C2C(C(C(N2)=O)=O)=CC(Cl)=C1 |
| Synonyms | 5-chloro-7-fluoro-2,3-dihydro-1H-indole-2,3-dione,
5-CHLORO-7-FLUORO-1H-INDOLE-2,3-DIONE,
953894-64-9,
SCHEMBL16832183,
CTK6G7084,
ZINC22169887,
AKOS000141880,
MCULE-4488927286,
NE14315,
J3.620.614D,
|
| Complexity | 271 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 198.984g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.565g/mol |
| Monoisotopic Mass | 198.984g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number