55579-69-6
5-(4-TRIFLUOROMETHYL-PHENYL)-CYCLOHEXANE-1,3-DIONE
Name5-(4-TRIFLUOROMETHYL-PHENYL)-CYCLOHEXANE-1,3-DIONE
1Identification
【Name】
5-(4-TRIFLUOROMETHYL-PHENYL)-CYCLOHEXANE-1,3-DIONE
【CAS】
【MDL】
MFCD00104794
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C13 H11 F3 O2
【pro_molWeight】
256.222
【Inchi】
InChI=1S/C13H11F3O2/c14-13(15,16)10-3-1-8(2-4-10)9-5-11(17)7-12(18)6-9/h1-4,9H,5-7H2
【InChIKey】
InChIKey=HBUZHLJGLPSVNC-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1C2CC(=O)CC(=O)C2)C(F)(F)F
【MOL File】
5-(4-TRIFLUOROMETHYL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:2
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
5-(4-TRIFLUOROMETHYL-PHENYL)-CYCLOHEXANE-1,3-DIONE.cml