537677-87-5
2-(4-METHYLPHENYL)-3-(4-NITROBENZOYL)-THIAZOLIDINE
Name2-(4-METHYLPHENYL)-3-(4-NITROBENZOYL)-THIAZOLIDINE
1Identification
【Name】
2-(4-METHYLPHENYL)-3-(4-NITROBENZOYL)-THIAZOLIDINE
【CAS】
【MDL】
MFCD03618285
【English Synonyms】
【Formula】
C17 H16 N2 O3 S
【MolWeight】
328.39
【Inchi】
InChI=1S/C17H16N2O3S/c1-12-2-4-14(5-3-12)17-18(10-11-23-17)16(20)13-6-8-15(9-7-13)19(21)22/h2-9,17H,10-11H2,1H3
【InChIKey】
InChIKey=URUHSVUUYGSFBK-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)C2N(CCS2)C(=O)c3ccc(cc3)[N+](=O)[O-]
【MOL File】
2-(4-METHYLPHENYL)-3….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(4-METHYLPHENYL)-3-(4-NITROBENZOYL)-THIAZOLIDINE.cml