537678-04-9
3-[(4-METHYL-3,5-DINITROPHENYL)SULFONYL]-2-(4-METHYLPHENYL)-THIAZOLIDINE
Name3-[(4-METHYL-3,5-DINITROPHENYL)SULFONYL]-2-(4-METHYLPHENYL)-THIAZOLIDINE
1Identification
【Name】
3-[(4-METHYL-3,5-DINITROPHENYL)SULFONYL]-2-(4-METHYLPHENYL)-THIAZOLIDINE
【CAS】
【MDL】
MFCD03618298
【English Synonyms】
【Formula】
C17 H17 N3 O6 S2
【MolWeight】
423.468
【Inchi】
InChI=1S/C17H17N3O6S2/c1-11-3-5-13(6-4-11)17-18(7-8-27-17)28(25,26)14-9-15(19(21)22)12(2)16(10-14)20(23)24/h3-6,9-10,17H,7-8H2,1-2H3
【InChIKey】
InChIKey=NOLOHCZMXOMILS-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)C2N(CCS2)S(=O)(=O)c3cc(c(c(c3)[N+](=O)[O-])C)[N+](=O)[O-]
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:9
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-[(4-METHYL-3,5-DINITROPHENYL)SULFONYL]-2-(4-METHYLPHENYL)-THIAZOLIDINE.cml