52191-01-2
1-(2,4-DIETHYLPHENYL)ETHAN-1-ONE
Name1-(2,4-DIETHYLPHENYL)ETHAN-1-ONE
1Identification
【Name】
1-(2,4-DIETHYLPHENYL)ETHAN-1-ONE
【CAS】
【MDL】
MFCD12031473
【English Synonyms】
【Formula】
C12 H16 O
【MolWeight】
176.257
【Inchi】
InChI=1S/C12H16O/c1-4-10-6-7-12(9(3)13)11(5-2)8-10/h6-8H,4-5H2,1-3H3
【InChIKey】
InChIKey=DAMITWKYTRCTAO-UHFFFAOYSA-N
【SMILES】
CCc1ccc(c(c1)CC)C(=O)C
【MOL File】
1-(2,4-DIETHYLPHENYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2,4-DIETHYLPHENYL)ETHAN-1-ONE.cml