| CAS Number | 854584-02-4 |
| Catalog Number | AG019RQ3(AGN-PC-08XTDC) |
| Chemical Name | 6,7-Difluoro-1,2,3,4-tetrahydroquinoxalin-2-one |
| IUPAC Name | 6,7-difluoro-3,4-dihydro-1H-quinoxalin-2-one |
| InChI | InChI=1S/C8H6F2N2O/c9-4-1-6-7(2-5(4)10)12-8(13)3-11-6/h1-2,11H,3H2,(H,12,13) |
| InChI Key | QBHISBCGNAGRAR-UHFFFAOYSA-N |
| MDL Number | MFCD18380787 |
| Molecular Formula | C8H6F2N2O |
| Molecular Weight | 184.1428 |
| SMILES | FC1=C(F)C=C2C(NCC(N2)=O)=C1 |
| Synonyms | 6,7-difluoro-1,2,3,4-tetrahydroquinoxalin-2-one,
854584-02-4,
2(1H)-Quinoxalinone, 6,7-difluoro-3,4-dihydro-,
AC1Q4LDS,
SCHEMBL14361898,
QBHISBCGNAGRAR-UHFFFAOYSA-N,
ZINC57926834,
AKOS022391940,
EN300-90156,
6,7-difluoro-3,4-dihydroquinoxalin-2(1H)-one,
|
| Complexity | 224 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.146g/mol |
| Monoisotopic Mass | 184.045g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number