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Home > Aldehydes > 825633-08-7
825633-08-7 | 3-Benzofurancarboxaldehyde, 2-ethyl-5-hydroxy-
CAS No: 825633-08-7 Catalog No: AG004YJ5 MDL No:
Product Description
Catalog Number:
AG004YJ5
Chemical Name:
3-Benzofurancarboxaldehyde, 2-ethyl-5-hydroxy-
CAS Number:
825633-08-7
Molecular Formula:
C11H10O3
Molecular Weight:
190.1953
IUPAC Name:
2-ethyl-5-hydroxy-1-benzofuran-3-carbaldehyde
InChI:
InChI=1S/C11H10O3/c1-2-10-9(6-12)8-5-7(13)3-4-11(8)14-10/h3-6,13H,2H2,1H3
InChI Key:
WFAPSKPOOZKYMP-UHFFFAOYSA-N
SMILES:
O=Cc1c(CC)oc2c1cc(O)cc2
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.063g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.198g/mol
Monoisotopic Mass:
190.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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