245072-83-7
4-[(2,5-DIOXOTETRAHYDRO-1H-IMIDAZOL-4-YLIDEN)METHYL]PHENYL 3-CHLORO-2,2-DIMETHYLPROPANOATE
Name4-[(2,5-DIOXOTETRAHYDRO-1H-IMIDAZOL-4-YLIDEN)METHYL]PHENYL 3-CHLORO-2,2-DIMETHYLPROPANOATE
pro_formulaC15 H15 Cl N2 O4
1Identification
【Name】
4-[(2,5-DIOXOTETRAHYDRO-1H-IMIDAZOL-4-YLIDEN)METHYL]PHENYL 3-CHLORO-2,2-DIMETHYLPROPANOATE
【CAS】
【MDL】
MFCD00828929
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C15 H15 Cl N2 O4
【pro_molWeight】
322.746
【Inchi】
InChI=1S/C15H15ClN2O4/c1-15(2,8-16)13(20)22-10-5-3-9(4-6-10)7-11-12(19)18-14(21)17-11/h3-7H,8H2,1-2H3,(H2,17,18,19,21)/b11-7+
【InChIKey】
InChIKey=MAEGLESFZMJTSQ-YRNVUSSQSA-N
【SMILES】
CC(C)(CCl)C(=O)Oc1ccc(cc1)/C=C/2\C(=O)NC(=O)N2
【MOL File】
4-[(2,5-DIOXOTETRAHY….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:6
XLogP3:2.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
4-[(2,5-DIOXOTETRAHYDRO-1H-IMIDAZOL-4-YLIDEN)METHYL]PHENYL 3-CHLORO-2,2-DIMETHYLPROPANOATE.cml