83123-19-7
1,2,4,5,6,7-HEXAHYDRO-2-(1-METHYLETHYLIDENE)-3H-INDOL-3-ONE
Name1,2,4,5,6,7-HEXAHYDRO-2-(1-METHYLETHYLIDENE)-3H-INDOL-3-ONE
1Identification
【Name】
1,2,4,5,6,7-HEXAHYDRO-2-(1-METHYLETHYLIDENE)-3H-INDOL-3-ONE
【CAS】
【MDL】
MFCD13178431
【English Synonyms】
【Formula】
C11 H15 N O
【MolWeight】
177.245
【Inchi】
InChI=1S/C11H15NO/c1-7(2)10-11(13)8-5-3-4-6-9(8)12-10/h12H,3-6H2,1-2H3
【InChIKey】
InChIKey=IQESAHMOFWZNIG-UHFFFAOYSA-N
【SMILES】
CC(=C1C(=O)C2=C(N1)CCCC2)C
【MOL File】
1,2,4,5,6,7-HEXAHYDR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2,4,5,6,7-HEXAHYDRO-2-(1-METHYLETHYLIDENE)-3H-INDOL-3-ONE.cml