56079-45-9
5,5-DIMETHYL-1-PHENYL-HEXANE-1,4-DIONE
Name
5,5-DIMETHYL-1-PHENYL-HEXANE-1,4-DIONE
pro_formula
C14 H18 O2
pro_molWeight
218.294
1Identification
【Name】
5,5-DIMETHYL-1-PHENYL-HEXANE-1,4-DIONE
【CAS】
【MDL】
MFCD09032160
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C14 H18 O2
【pro_molWeight】
218.294
【Inchi】
InChI=1S/C14H18O2/c1-14(2,3)13(16)10-9-12(15)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
【InChIKey】
InChIKey=IZBIILHAJJUBNU-UHFFFAOYSA-N
【SMILES】
CC(C)(C)C(=O)CCC(=O)c1ccccc1
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:2
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
5,5-DIMETHYL-1-PHENYL-HEXANE-1,4-DIONE.cml
quick_release
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