878292-19-4
4-(CHLOROACETYL)-7-FLUORO-3,4-DIHYDRO-3,3-DIMETHYL-2(1H)-QUINOXALINONE
Name4-(CHLOROACETYL)-7-FLUORO-3,4-DIHYDRO-3,3-DIMETHYL-2(1H)-QUINOXALINONE
FormulaC12 H12 Cl F N2 O2
1Identification
【Name】
4-(CHLOROACETYL)-7-FLUORO-3,4-DIHYDRO-3,3-DIMETHYL-2(1H)-QUINOXALINONE
【CAS】
【MDL】
MFCD16659821
【English Synonyms】
【Formula】
C12 H12 Cl F N2 O2
【MolWeight】
270.69
【Inchi】
InChI=1S/C12H12ClFN2O2/c1-12(2)11(18)15-8-5-7(14)3-4-9(8)16(12)10(17)6-13/h3-5H,6H2,1-2H3,(H,15,18)
【InChIKey】
InChIKey=PGNMEEVIBHPLQN-UHFFFAOYSA-N
【SMILES】
CC1(C(=O)Nc2cc(ccc2N1C(=O)CCl)F)C
【MOL File】
4-(CHLOROACETYL)-7-F….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(CHLOROACETYL)-7-FLUORO-3,4-DIHYDRO-3,3-DIMETHYL-2(1H)-QUINOXALINONE.cml