519056-53-2
ETHYL 3-AMINO-4-(METHYLSULFONYL)-5-(METHYLTHIO)THIOPHENE-2-CARBOXYLATE
Name
ETHYL 3-AMINO-4-(METHYLSULFONYL)-5-(METHYLTHIO)THIOPHENE-2-CARBOXYLATE
Formula
C9 H13 N O4 S3
MolWeight
295.403
1Identification
【Name】
ETHYL 3-AMINO-4-(METHYLSULFONYL)-5-(METHYLTHIO)THIOPHENE-2-CARBOXYLATE
【CAS】
【MDL】
MFCD00830928
【English Synonyms】
【Formula】
C9 H13 N O4 S3
【MolWeight】
295.403
【Inchi】
InChI=1S/C9H13NO4S3/c1-4-14-8(11)6-5(10)7(17(3,12)13)9(15-2)16-6/h4,10H2,1-3H3
【InChIKey】
InChIKey=OXPYNZFAYUQNQZ-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(c(c(s1)SC)S(=O)(=O)C)N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 3-AMINO-4-(METHYLSULFONYL)-5-(METHYLTHIO)THIOPHENE-2-CARBOXYLATE.cml
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