862785-73-7
2-(ETHYLSULFONYL)-4-(3-METHOXYPHENYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE
Name2-(ETHYLSULFONYL)-4-(3-METHOXYPHENYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE
FormulaC14 H13 F3 N2 O3 S
1Identification
【Name】
2-(ETHYLSULFONYL)-4-(3-METHOXYPHENYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE
【CAS】
【MDL】
MFCD05861685
【English Synonyms】
【Formula】
C14 H13 F3 N2 O3 S
【MolWeight】
346.328
【Inchi】
InChI=1S/C14H13F3N2O3S/c1-3-23(20,21)13-18-11(8-12(19-13)14(15,16)17)9-5-4-6-10(7-9)22-2/h4-8H,3H2,1-2H3
【InChIKey】
InChIKey=GMXWQUTXRTUBMZ-UHFFFAOYSA-N
【SMILES】
CCS(=O)(=O)c1nc(cc(n1)C(F)(F)F)c2cccc(c2)OC
【MOL File】
2-(ETHYLSULFONYL)-4-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(ETHYLSULFONYL)-4-(3-METHOXYPHENYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE.cml