55317-02-7
2-METHOXY-1-(2,4,6-TRIHYDROXYPHENYL)ETHANONE
Name2-METHOXY-1-(2,4,6-TRIHYDROXYPHENYL)ETHANONE
1Identification
【Name】
2-METHOXY-1-(2,4,6-TRIHYDROXYPHENYL)ETHANONE
【CAS】
【MDL】
MFCD03788946
【English Synonyms】
【Formula】
C9 H10 O5
【MolWeight】
198.173
【Inchi】
InChI=1S/C9H10O5/c1-14-4-8(13)9-6(11)2-5(10)3-7(9)12/h2-3,10-12H,4H2,1H3
【InChIKey】
InChIKey=FYRXXSCCOWRCLX-UHFFFAOYSA-N
【SMILES】
COCC(=O)c1c(cc(cc1O)O)O
【MOL File】
2-METHOXY-1-(2,4,6-T….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-METHOXY-1-(2,4,6-TRIHYDROXYPHENYL)ETHANONE.cml