5863-20-7
ETHYL 5-METHYL-1,1-DIOXO-1,6-DIHYDRO-1LAMBDA6-1,2,6-THIADIAZINE-3-CARBOXYLATE
NameETHYL 5-METHYL-1,1-DIOXO-1,6-DIHYDRO-1LAMBDA6-1,2,6-THIADIAZINE-3-CARBOXYLATE
1Identification
【Name】
ETHYL 5-METHYL-1,1-DIOXO-1,6-DIHYDRO-1LAMBDA6-1,2,6-THIADIAZINE-3-CARBOXYLATE
【CAS】
【MDL】
MFCD08443997
【English Synonyms】
【Formula】
C7 H10 N2 O4 S
【MolWeight】
218.232
【Inchi】
InChI=1S/C7H10N2O4S/c1-3-13-7(10)6-4-5(2)8-14(11,12)9-6/h4,8H,3H2,1-2H3
【InChIKey】
InChIKey=XPFJZWOGEBQAHN-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C1=NS(=O)(=O)NC(=C1)C
【MOL File】
ETHYL 5-METHYL-1,1-D….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 5-METHYL-1,1-DIOXO-1,6-DIHYDRO-1LAMBDA6-1,2,6-THIADIAZINE-3-CARBOXYLATE.cml