15116-14-0
1-(2,4-DIHYDROXYPHENYL)-3-METHYLBUTAN-1-ONE
Name1-(2,4-DIHYDROXYPHENYL)-3-METHYLBUTAN-1-ONE
1Identification
【Name】
1-(2,4-DIHYDROXYPHENYL)-3-METHYLBUTAN-1-ONE
【CAS】
【MDL】
MFCD00068807
【English Synonyms】
【Formula】
C11 H14 O3
【MolWeight】
194.229
【Inchi】
InChI=1S/C11H14O3/c1-7(2)5-10(13)9-4-3-8(12)6-11(9)14/h3-4,6-7,12,14H,5H2,1-2H3
【InChIKey】
InChIKey=AFLATBREDGLLKS-UHFFFAOYSA-N
【SMILES】
CC(C)CC(=O)c1ccc(cc1O)O
【MOL File】
1-(2,4-DIHYDROXYPHEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2,4-DIHYDROXYPHENYL)-3-METHYLBUTAN-1-ONE.cml