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174775-48-5 | 2-Benzofurancarboxylic acid, 5-amino-, ethyl ester
CAS No: 174775-48-5 Catalog No: AG001ZY5 MDL No:MFCD08275091
Product Description
Catalog Number:
AG001ZY5
Chemical Name:
2-Benzofurancarboxylic acid, 5-amino-, ethyl ester
CAS Number:
174775-48-5
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
MDL Number:
MFCD08275091
IUPAC Name:
ethyl 5-amino-1-benzofuran-2-carboxylate
InChI:
InChI=1S/C11H11NO3/c1-2-14-11(13)10-6-7-5-8(12)3-4-9(7)15-10/h3-6H,2,12H2,1H3
InChI Key:
YFFLLDHEEWSHQG-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2c(o1)ccc(c2)N
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.213g/mol
Monoisotopic Mass:
205.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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