898756-01-9
2',3'-DIMETHOXY-4-(5,5-DIMETHYL-1,3-DIOXAN-2-YL)BUTYROPHENONE
Name2',3'-DIMETHOXY-4-(5,5-DIMETHYL-1,3-DIOXAN-2-YL)BUTYROPHENONE
1Identification
【Name】
2',3'-DIMETHOXY-4-(5,5-DIMETHYL-1,3-DIOXAN-2-YL)BUTYROPHENONE
【CAS】
【MDL】
MFCD03844310
【English Synonyms】
【Formula】
C18 H26 O5
【MolWeight】
322.398
【Inchi】
InChI=1S/C18H26O5/c1-18(2)11-22-16(23-12-18)10-6-8-14(19)13-7-5-9-15(20-3)17(13)21-4/h5,7,9,16H,6,8,10-12H2,1-4H3
【InChIKey】
InChIKey=KLLBIYSNVTUGFY-UHFFFAOYSA-N
【SMILES】
CC1(COC(OC1)CCCC(=O)c2cccc(c2OC)OC)C
【MOL File】
2',3'-DIMETHOXY-4-(5….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2',3'-DIMETHOXY-4-(5,5-DIMETHYL-1,3-DIOXAN-2-YL)BUTYROPHENONE.cml