562079-21-4
1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-6-METHYL-1,2,3,4-TETRAHYDROQUINOLINE
Name1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-6-METHYL-1,2,3,4-TETRAHYDROQUINOLINE
1Identification
【Name】
1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-6-METHYL-1,2,3,4-TETRAHYDROQUINOLINE
【CAS】
【MDL】
MFCD00245612
【English Synonyms】
【Formula】
C20 H25 N O2 S
【MolWeight】
343.488
【Inchi】
InChI=1S/C20H25NO2S/c1-15-7-12-19-16(14-15)6-5-13-21(19)24(22,23)18-10-8-17(9-11-18)20(2,3)4/h7-12,14H,5-6,13H2,1-4H3
【InChIKey】
InChIKey=HPACZNSFSPHFAV-UHFFFAOYSA-N
【SMILES】
Cc1ccc2c(c1)CCCN2S(=O)(=O)c3ccc(cc3)C(C)(C)C
【MOL File】
1-((4-(TERT-BUTYL)PH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-6-METHYL-1,2,3,4-TETRAHYDROQUINOLINE.cml