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Home > Aldehydes > 917867-68-6
917867-68-6 | 4-Benzofurancarboxaldehyde, 5-hydroxy-2,3-diphenyl-
CAS No: 917867-68-6 Catalog No: AG006O0C MDL No:
Product Description
Catalog Number:
AG006O0C
Chemical Name:
4-Benzofurancarboxaldehyde, 5-hydroxy-2,3-diphenyl-
CAS Number:
917867-68-6
Molecular Formula:
C21H14O3
Molecular Weight:
314.3341
IUPAC Name:
5-hydroxy-2,3-diphenyl-1-benzofuran-4-carbaldehyde
InChI:
InChI=1S/C21H14O3/c22-13-16-17(23)11-12-18-20(16)19(14-7-3-1-4-8-14)21(24-18)15-9-5-2-6-10-15/h1-13,23H
InChI Key:
HAWWNWBKOJPAEQ-UHFFFAOYSA-N
SMILES:
O=Cc1c(O)ccc2c1c(c1ccccc1)c(o2)c1ccccc1
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.094g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.34g/mol
Monoisotopic Mass:
314.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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