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114195-14-1 | 3-Benzofurancarboxylic acid, 5-hydroxy-, ethyl ester
CAS No: 114195-14-1 Catalog No: AG000ARX MDL No:
Product Description
Catalog Number:
AG000ARX
Chemical Name:
3-Benzofurancarboxylic acid, 5-hydroxy-, ethyl ester
CAS Number:
114195-14-1
Molecular Formula:
C11H10O4
Molecular Weight:
206.1947
IUPAC Name:
ethyl 5-hydroxy-1-benzofuran-3-carboxylate
InChI:
InChI=1S/C11H10O4/c1-2-14-11(13)9-6-15-10-4-3-7(12)5-8(9)10/h3-6,12H,2H2,1H3
InChI Key:
GJCZNWVYTVUKGO-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1coc2c1cc(O)cc2
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.058g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.197g/mol
Monoisotopic Mass:
206.058g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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