56008-20-9
3,6,6-TRIMETHYL-6,7-DIHYDRO-1H-INDOL-4(5H)-ONE
Name3,6,6-TRIMETHYL-6,7-DIHYDRO-1H-INDOL-4(5H)-ONE
1Identification
【Name】
3,6,6-TRIMETHYL-6,7-DIHYDRO-1H-INDOL-4(5H)-ONE
【CAS】
【MDL】
MFCD08060464
【English Synonyms】
【Formula】
C11 H15 N O
【MolWeight】
177.245
【Inchi】
InChI=1S/C11H15NO/c1-7-6-12-8-4-11(2,3)5-9(13)10(7)8/h6,12H,4-5H2,1-3H3
【InChIKey】
InChIKey=REGIWYJKSKEPMU-UHFFFAOYSA-N
【SMILES】
Cc1c[nH]c2c1C(=O)CC(C2)(C)C
【MOL File】
3,6,6-TRIMETHYL-6,7-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
3,6,6-TRIMETHYL-6,7-DIHYDRO-1H-INDOL-4(5H)-ONE.cml