| CAS Number | 348133-45-9 |
| Catalog Number | AG00CWLR |
| Chemical Name | 6-fluoro-1-methyl-2,3-dihydro-1H-1,3-benzodiazol-2-one |
| IUPAC Name | 5-fluoro-3-methyl-1H-benzimidazol-2-one |
| InChI | InChI=1S/C8H7FN2O/c1-11-7-4-5(9)2-3-6(7)10-8(11)12/h2-4H,1H3,(H,10,12) |
| InChI Key | UUVUHCAHXNGVLI-UHFFFAOYSA-N |
| MDL Number | MFCD24608392 |
| Molecular Formula | C8H7FN2O |
| Molecular Weight | 166.1524 |
| SMILES | FC=1C=CC2=C(N(C(N2)=O)C)C1 |
| Synonyms | 348133-45-9,
6-fluoro-1-methyl-1H-benzo[d]imidazol-2(3H)-one,
6-fluoro-1-methyl-1,3-dihydro-2h-benzo[d]imidazol-2-one,
SCHEMBL6770061,
ZINC45238484,
AS-44054,
6-fluoro-1-methyl-2,3-dihydro-1H-1,3-benzodiazol-2-one,
2H-Benzimidazol-2-one,6-fluoro-1,3-dihydro-1-methyl-(9CI),
2H-Benzimidazol-2-one, 6-fluoro-1,3-dihydro-1-methyl- (9CI),
|
| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.155g/mol |
| Monoisotopic Mass | 166.054g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number