67311-84-6
2,3,4,5,6,7-HEXAHYDRO-2-METHYL-1H-ISOINDOL-1-ONE
Name2,3,4,5,6,7-HEXAHYDRO-2-METHYL-1H-ISOINDOL-1-ONE
1Identification
【Name】
2,3,4,5,6,7-HEXAHYDRO-2-METHYL-1H-ISOINDOL-1-ONE
【CAS】
【MDL】
MFCD12924216
【English Synonyms】
【Formula】
C9 H13 N O
【MolWeight】
151.208
【Inchi】
InChI=1S/C9H13NO/c1-10-6-7-4-2-3-5-8(7)9(10)11/h2-6H2,1H3
【InChIKey】
InChIKey=ZXOXQSPKYJLPOP-UHFFFAOYSA-N
【SMILES】
CN1CC2=C(C1=O)CCCC2
【MOL File】
2,3,4,5,6,7-HEXAHYDR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,3,4,5,6,7-HEXAHYDRO-2-METHYL-1H-ISOINDOL-1-ONE.cml