77995-09-6
ETHYL 4-(4-FLUOROPHENYL)PYRIMIDINE-5-CARBOXYLATE
NameETHYL 4-(4-FLUOROPHENYL)PYRIMIDINE-5-CARBOXYLATE
1Identification
【Name】
ETHYL 4-(4-FLUOROPHENYL)PYRIMIDINE-5-CARBOXYLATE
【CAS】
【MDL】
MFCD16660638
【English Synonyms】
【Formula】
C13 H11 F N2 O2
【MolWeight】
246.24
【Inchi】
InChI=1S/C13H11FN2O2/c1-2-18-13(17)11-7-15-8-16-12(11)9-3-5-10(14)6-4-9/h3-8H,2H2,1H3
【InChIKey】
InChIKey=BJNNGVMYXJNZRH-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1cncnc1c2ccc(cc2)F
【MOL File】
ETHYL 4-(4-FLUOROPHE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 4-(4-FLUOROPHENYL)PYRIMIDINE-5-CARBOXYLATE.cml