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Home Carboxys [2,3'-Bithiophene]-4'-carboxylicacid, 5'-amino-, ethyl ester

[2,3'-Bithiophene]-4'-carboxylicacid, 5'-amino-, ethyl ester

CAS No.:
243669-48-9
Catalog Number:
AG006W27
Molecular Formula:
C11H11NO2S2
Molecular Weight:
253.3405
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Product Description
Catalog Number:
AG006W27
Chemical Name:
[2,3'-Bithiophene]-4'-carboxylicacid, 5'-amino-, ethyl ester
CAS Number:
243669-48-9
Molecular Formula:
C11H11NO2S2
Molecular Weight:
253.3405
MDL Number:
MFCD00115120
IUPAC Name:
ethyl 2-amino-4-thiophen-2-ylthiophene-3-carboxylate
InChI:
InChI=1S/C11H11NO2S2/c1-2-14-11(13)9-7(6-16-10(9)12)8-4-3-5-15-8/h3-6H,2,12H2,1H3
InChI Key:
AKFDBWIUWIWHRK-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(N)scc1c1cccs1
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.023g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
253.334g/mol
Monoisotopic Mass:
253.023g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties