5384-13-4
1-(2-HYDROXY-4,5-DIMETHYLPHENYL)PROPAN-1-ONE
Name1-(2-HYDROXY-4,5-DIMETHYLPHENYL)PROPAN-1-ONE
1Identification
【Name】
1-(2-HYDROXY-4,5-DIMETHYLPHENYL)PROPAN-1-ONE
【CAS】
【MDL】
MFCD03424520
【English Synonyms】
【Formula】
C11 H14 O2
【MolWeight】
178.23
【Inchi】
InChI=1S/C11H14O2/c1-4-10(12)9-5-7(2)8(3)6-11(9)13/h5-6,13H,4H2,1-3H3
【InChIKey】
InChIKey=JQMFVNFIGSUPBI-UHFFFAOYSA-N
【SMILES】
CCC(=O)c1cc(c(cc1O)C)C
【MOL File】
1-(2-HYDROXY-4,5-DIM….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-HYDROXY-4,5-DIMETHYLPHENYL)PROPAN-1-ONE.cml