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Home > Aldehydes > 872595-54-5
872595-54-5 | 2H-Benzofuro[3,2-g]-1-benzopyran-4-carboxaldehyde, 2-oxo-
CAS No: 872595-54-5 Catalog No: AG008EME MDL No:
Product Description
Catalog Number:
AG008EME
Chemical Name:
2H-Benzofuro[3,2-g]-1-benzopyran-4-carboxaldehyde, 2-oxo-
CAS Number:
872595-54-5
Molecular Formula:
C16H8O4
Molecular Weight:
264.2323
IUPAC Name:
2-oxo-[1]benzofuro[3,2-g]chromene-4-carbaldehyde
InChI:
InChI=1S/C16H8O4/c17-8-9-5-16(18)20-14-7-15-12(6-11(9)14)10-3-1-2-4-13(10)19-15/h1-8H
InChI Key:
UJPXHNQGGABSND-UHFFFAOYSA-N
SMILES:
O=Cc1cc(=O)oc2c1cc1c(c2)oc2c1cccc2
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.042g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.236g/mol
Monoisotopic Mass:
264.042g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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