65038-93-9
3-METHYL-4,5,6,7-TETRAHYDRO-2H-ISOINDOL-4-ONE
Name3-METHYL-4,5,6,7-TETRAHYDRO-2H-ISOINDOL-4-ONE
1Identification
【Name】
3-METHYL-4,5,6,7-TETRAHYDRO-2H-ISOINDOL-4-ONE
【CAS】
【MDL】
MFCD12924223
【English Synonyms】
【Formula】
C9 H11 N O
【MolWeight】
149.192
【Inchi】
InChI=1S/C9H11NO/c1-6-9-7(5-10-6)3-2-4-8(9)11/h5,10H,2-4H2,1H3
【InChIKey】
InChIKey=HOJHBXQJPYLKCU-UHFFFAOYSA-N
【SMILES】
Cc1c2c(c[nH]1)CCCC2=O
【MOL File】
3-METHYL-4,5,6,7-TET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-METHYL-4,5,6,7-TETRAHYDRO-2H-ISOINDOL-4-ONE.cml