1245642-64-1
2-(3-CHLOROPHENYLAMINO)-5-FLUOROPYRIMIDIN-4(3H)-ONE
Name2-(3-CHLOROPHENYLAMINO)-5-FLUOROPYRIMIDIN-4(3H)-ONE
1Identification
【Name】
2-(3-CHLOROPHENYLAMINO)-5-FLUOROPYRIMIDIN-4(3H)-ONE
【CAS】
【MDL】
MFCD16876245
【English Synonyms】
【Formula】
C10 H7 Cl F N3 O
【MolWeight】
239.636
【Inchi】
InChI=1S/C10H7ClFN3O/c11-6-2-1-3-7(4-6)14-10-13-5-8(12)9(16)15-10/h1-5H,(H2,13,14,15,16)
【InChIKey】
InChIKey=FFNWAMKBYIJROR-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)Cl)Nc2[nH]c(=O)c(cn2)F
【MOL File】
2-(3-CHLOROPHENYLAMI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(3-CHLOROPHENYLAMINO)-5-FLUOROPYRIMIDIN-4(3H)-ONE.cml