866524-09-6
ETHYL 5-(PYRIDIN-4-YL)THIOPHENE-2-CARBOXYLATE
NameETHYL 5-(PYRIDIN-4-YL)THIOPHENE-2-CARBOXYLATE
1Identification
【Name】
ETHYL 5-(PYRIDIN-4-YL)THIOPHENE-2-CARBOXYLATE
【CAS】
【MDL】
MFCD15477812
【English Synonyms】
【Formula】
C12 H11 N O2 S
【MolWeight】
233.29
【Inchi】
InChI=1S/C12H11NO2S/c1-2-15-12(14)11-4-3-10(16-11)9-5-7-13-8-6-9/h3-8H,2H2,1H3
【InChIKey】
InChIKey=GJRUTSJBPMBRSC-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1ccc(s1)c2ccncc2
【MOL File】
ETHYL 5-(PYRIDIN-4-Y….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 5-(PYRIDIN-4-YL)THIOPHENE-2-CARBOXYLATE.cml