882041-48-7
4,5-DIHYDRO-4-IODO-1'-METHYL-SPIRO[FURAN-2(3H),3'-[3H]INDOL]-2'(1'H)-ONE
Name4,5-DIHYDRO-4-IODO-1'-METHYL-SPIRO[FURAN-2(3H),3'-[3H]INDOL]-2'(1'H)-ONE
1Identification
【Name】
4,5-DIHYDRO-4-IODO-1'-METHYL-SPIRO[FURAN-2(3H),3'-[3H]INDOL]-2'(1'H)-ONE
【CAS】
【MDL】
MFCD08752385
【English Synonyms】
【Formula】
C12 H12 I N O2
【MolWeight】
329.132
【Inchi】
InChI=1S/C12H12INO2/c1-14-10-5-3-2-4-9(10)12(11(14)15)6-8(13)7-16-12/h2-5,8H,6-7H2,1H3
【InChIKey】
InChIKey=CWBDOKADQITBKQ-UHFFFAOYSA-N
【SMILES】
CN1c2ccccc2C3(C1=O)CC(CO3)I
【MOL File】
4,5-DIHYDRO-4-IODO-1….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4,5-DIHYDRO-4-IODO-1'-METHYL-SPIRO[FURAN-2(3H),3'-[3H]INDOL]-2'(1'H)-ONE.cml