19739-00-5
2-PROPEN-1-ONE, 3-(3,5-DIBROMO-2-HYDROXYPHENYL)-1-(2,4-DIHYDROXYPHENYL)-
Name2-PROPEN-1-ONE, 3-(3,5-DIBROMO-2-HYDROXYPHENYL)-1-(2,4-DIHYDROXYPHENYL)-
1Identification
【Name】
2-PROPEN-1-ONE, 3-(3,5-DIBROMO-2-HYDROXYPHENYL)-1-(2,4-DIHYDROXYPHENYL)-
【CAS】
【MDL】
MFCD01696155
【English Synonyms】
【Formula】
C15 H10 Br2 O4
【MolWeight】
414.048
【Inchi】
InChI=1S/C15H10Br2O4/c16-9-5-8(15(21)12(17)6-9)1-4-13(19)11-3-2-10(18)7-14(11)20/h1-7,18,20-21H/b4-1+
【InChIKey】
InChIKey=NOGALXAJDDMFDE-DAFODLJHSA-N
【SMILES】
c1cc(c(cc1O)O)C(=O)/C=C/c2cc(cc(c2O)Br)Br
【MOL File】
2-PROPEN-1-ONE, 3-(3….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-PROPEN-1-ONE, 3-(3,5-DIBROMO-2-HYDROXYPHENYL)-1-(2,4-DIHYDROXYPHENYL)-.cml