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4905-71-9
2-(1,1-DIOXO-TETRAHYDRO-1L6-THIOPHEN-3-YL)-3-OXO-BUTYRIC ACID ETHYL ESTER
Name
2-(1,1-DIOXO-TETRAHYDRO-1L6-THIOPHEN-3-YL)-3-OXO-BUTYRIC ACID ETHYL ESTER
Formula
C10 H16 O5 S
MolWeight
248.297
1Identification
【Name】
2-(1,1-DIOXO-TETRAHYDRO-1L6-THIOPHEN-3-YL)-3-OXO-BUTYRIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD00188768
【English Synonyms】
【Formula】
C10 H16 O5 S
【MolWeight】
248.297
【Inchi】
InChI=1S/C10H16O5S/c1-3-15-10(12)9(7(2)11)8-4-5-16(13,14)6-8/h8-9H,3-6H2,1-2H3
【InChIKey】
InChIKey=WINWJOBODCLFQL-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C(C1CCS(=O)(=O)C1)C(=O)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(1,1-DIOXO-TETRAHYDRO-1L6-THIOPHEN-3-YL)-3-OXO-BUTYRIC ACID ETHYL ESTER.cml
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