543734-06-1
2-(1,3-BENZODIOXOL-5-YLMETHYLENE)-1,6-DIOXASPIRO[4.4]NONANE
Name2-(1,3-BENZODIOXOL-5-YLMETHYLENE)-1,6-DIOXASPIRO[4.4]NONANE
1Identification
【Name】
2-(1,3-BENZODIOXOL-5-YLMETHYLENE)-1,6-DIOXASPIRO[4.4]NONANE
【CAS】
【MDL】
MFCD22543806
【English Synonyms】
【Formula】
C15 H16 O4
【MolWeight】
260.287
【Inchi】
InChI=1S/C15H16O4/c1-5-15(18-7-1)6-4-12(19-15)8-11-2-3-13-14(9-11)17-10-16-13/h2-3,8-9H,1,4-7,10H2/b12-8+
【InChIKey】
InChIKey=JEZAEIFFZMHOPT-XYOKQWHBSA-N
【SMILES】
c1cc2c(cc1/C=C/3\CCC4(O3)CCCO4)OCO2
【MOL File】
2-(1,3-BENZODIOXOL-5….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-(1,3-BENZODIOXOL-5-YLMETHYLENE)-1,6-DIOXASPIRO[4.4]NONANE.cml