Home Carboxys Ethyl 4-(pyridin-4-yl)thiazole-2-carboxylate

Ethyl 4-(pyridin-4-yl)thiazole-2-carboxylate

CAS No.:
216867-38-8
Catalog Number:
AG003Q93
Molecular Formula:
C11H10N2O2S
Molecular Weight:
234.2743
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Product Description
Catalog Number:
AG003Q93
Chemical Name:
Ethyl 4-(pyridin-4-yl)thiazole-2-carboxylate
CAS Number:
216867-38-8
Molecular Formula:
C11H10N2O2S
Molecular Weight:
234.2743
MDL Number:
MFCD06797362
IUPAC Name:
ethyl 4-pyridin-4-yl-1,3-thiazole-2-carboxylate
InChI:
InChI=1S/C11H10N2O2S/c1-2-15-11(14)10-13-9(7-16-10)8-3-5-12-6-4-8/h3-7H,2H2,1H3
InChI Key:
KMLUEVQSOXDFPY-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1scc(n1)c1ccncc1
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.046g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.273g/mol
Monoisotopic Mass:
234.046g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties