283593-05-5
1,2,3,4-TETRAHYDRO-6-METHYL-2-OXO-4-[4-(TRIFLUOROMETHYL)PHENYL]-5-PYRIMIDINECARBOXYLIC ACID ETHYL ESTER
Name1,2,3,4-TETRAHYDRO-6-METHYL-2-OXO-4-[4-(TRIFLUOROMETHYL)PHENYL]-5-PYRIMIDINECARBOXYLIC ACID ETHYL ESTER
1Identification
【Name】
1,2,3,4-TETRAHYDRO-6-METHYL-2-OXO-4-[4-(TRIFLUOROMETHYL)PHENYL]-5-PYRIMIDINECARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD01191914
【English Synonyms】
【Formula】
C15 H15 F3 N2 O3
【MolWeight】
328.289
【Inchi】
InChI=1S/C15H15F3N2O3/c1-3-23-13(21)11-8(2)19-14(22)20-12(11)9-4-6-10(7-5-9)15(16,17)18/h4-7,12H,3H2,1-2H3,(H2,19,20,22)
【InChIKey】
InChIKey=OFLFPNJNGFZVLG-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C1=C(NC(=O)NC1c2ccc(cc2)C(F)(F)F)C
【MOL File】
1,2,3,4-TETRAHYDRO-6….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2,3,4-TETRAHYDRO-6-METHYL-2-OXO-4-[4-(TRIFLUOROMETHYL)PHENYL]-5-PYRIMIDINECARBOXYLIC ACID ETHYL ESTER.cml