914201-16-4
4-ISOPROPYL-2-PENTAFLUORO ETHYL-PYRIMIDINE-5-CARBOXYLIC ACID
Name4-ISOPROPYL-2-PENTAFLUORO ETHYL-PYRIMIDINE-5-CARBOXYLIC ACID
pro_formulaC10 H9 F5 N2 O2
1Identification
【Name】
4-ISOPROPYL-2-PENTAFLUORO ETHYL-PYRIMIDINE-5-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD08689827
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C10 H9 F5 N2 O2
【pro_molWeight】
284.183
【Inchi】
InChI=1S/C10H9F5N2O2/c1-4(2)6-5(7(18)19)3-16-8(17-6)9(11,12)10(13,14)15/h3-4H,1-2H3,(H,18,19)
【InChIKey】
InChIKey=DUOWWEAVVNTNLQ-UHFFFAOYSA-N
【SMILES】
CC(C)c1c(cnc(n1)C(C(F)(F)F)(F)F)C(=O)O
【MOL File】
4-ISOPROPYL-2-PENTAF….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:4
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4-ISOPROPYL-2-PENTAFLUORO ETHYL-PYRIMIDINE-5-CARBOXYLIC ACID.cml