294848-63-8
DIMETHYL 3-[(2,6-DIMETHYLANILINO)CARBONYL]-1,3-THIAZOLANE-2,4-DICARBOXYLATE
NameDIMETHYL 3-[(2,6-DIMETHYLANILINO)CARBONYL]-1,3-THIAZOLANE-2,4-DICARBOXYLATE
pro_formulaC16 H20 N2 O5 S
1Identification
【Name】
DIMETHYL 3-[(2,6-DIMETHYLANILINO)CARBONYL]-1,3-THIAZOLANE-2,4-DICARBOXYLATE
【CAS】
【MDL】
MFCD02169759
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C16 H20 N2 O5 S
【pro_molWeight】
352.409
【Inchi】
InChI=1S/C16H20N2O5S/c1-9-6-5-7-10(2)12(9)17-16(21)18-11(14(19)22-3)8-24-13(18)15(20)23-4/h5-7,11,13H,8H2,1-4H3,(H,17,21)
【InChIKey】
InChIKey=KPBNXPWICJDQCQ-UHFFFAOYSA-N
【SMILES】
Cc1cccc(c1NC(=O)N2C(CSC2C(=O)OC)C(=O)OC)C
【MOL File】
DIMETHYL 3-[(2,6-DIM….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:7
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
DIMETHYL 3-[(2,6-DIMETHYLANILINO)CARBONYL]-1,3-THIAZOLANE-2,4-DICARBOXYLATE.cml