Home Carboxys Ethyl 5-aminobenzo[b]thiophene-2-carboxylate

Ethyl 5-aminobenzo[b]thiophene-2-carboxylate

CAS No.:
25785-10-8
Catalog Number:
AG007LZY
Molecular Formula:
C11H11NO2S
Molecular Weight:
221.2755
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Product Description
Catalog Number:
AG007LZY
Chemical Name:
Ethyl 5-aminobenzo[b]thiophene-2-carboxylate
CAS Number:
25785-10-8
Molecular Formula:
C11H11NO2S
Molecular Weight:
221.2755
MDL Number:
MFCD02947283
IUPAC Name:
ethyl 5-amino-1-benzothiophene-2-carboxylate
InChI:
InChI=1S/C11H11NO2S/c1-2-14-11(13)10-6-7-5-8(12)3-4-9(7)15-10/h3-6H,2,12H2,1H3
InChI Key:
CHFISKGSWVIUIX-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2c(s1)ccc(c2)N
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.051g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.274g/mol
Monoisotopic Mass:
221.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties