7019-95-6
2,5-CYCLOHEXADIEN-1-ONE, 2,6-DI-TERT-BUTYL-4-(PIPERIDINOMETHYLENE)-
Name2,5-CYCLOHEXADIEN-1-ONE, 2,6-DI-TERT-BUTYL-4-(PIPERIDINOMETHYLENE)-
1Identification
【Name】
2,5-CYCLOHEXADIEN-1-ONE, 2,6-DI-TERT-BUTYL-4-(PIPERIDINOMETHYLENE)-
【CAS】
【MDL】
MFCD00401531
【English Synonyms】
【Formula】
C20 H31 N O
【MolWeight】
301.471
【Inchi】
InChI=1S/C20H31NO/c1-19(2,3)16-12-15(14-21-10-8-7-9-11-21)13-17(18(16)22)20(4,5)6/h12-14H,7-11H2,1-6H3
【InChIKey】
InChIKey=YTVBXPMHQOAMCF-UHFFFAOYSA-N
【SMILES】
CC(C)(C)C1=CC(=CN2CCCCC2)C=C(C1=O)C(C)(C)C
【MOL File】
2,5-CYCLOHEXADIEN-1-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,5-CYCLOHEXADIEN-1-ONE, 2,6-DI-TERT-BUTYL-4-(PIPERIDINOMETHYLENE)-.cml