718-67-2
5-(1-CYCLOHEXEN-1-YL)-5-METHYL-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE
Name5-(1-CYCLOHEXEN-1-YL)-5-METHYL-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE
1Identification
【Name】
5-(1-CYCLOHEXEN-1-YL)-5-METHYL-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE
【CAS】
【MDL】
MFCD00869187
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C11 H14 N2 O3
【pro_molWeight】
222.243
【Inchi】
InChI=1S/C11H14N2O3/c1-11(7-5-3-2-4-6-7)8(14)12-10(16)13-9(11)15/h5H,2-4,6H2,1H3,(H2,12,13,14,15,16)
【InChIKey】
InChIKey=RRLOKVSPWZSADO-UHFFFAOYSA-N
【SMILES】
CC1(C(=O)NC(=O)NC1=O)C2=CCCCC2
【MOL File】
5-(1-CYCLOHEXEN-1-YL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:5
XLogP3:1.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
5-(1-CYCLOHEXEN-1-YL)-5-METHYL-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE.cml