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147556-50-1 | 2,4-Pentadien-1-one, 5-(2-furanyl)-3-hydroxy-1-phenyl-, (2Z,4E)-
CAS No: 147556-50-1 Catalog No: AG001EYW MDL No:
Product Description
Catalog Number:
AG001EYW
Chemical Name:
2,4-Pentadien-1-one, 5-(2-furanyl)-3-hydroxy-1-phenyl-, (2Z,4E)-
CAS Number:
147556-50-1
Molecular Formula:
C15H12O3
Molecular Weight:
240.2540
IUPAC Name:
5-(furan-2-yl)-1-hydroxy-1-phenylpenta-1,4-dien-3-one
InChI:
InChI=1S/C15H12O3/c16-13(8-9-14-7-4-10-18-14)11-15(17)12-5-2-1-3-6-12/h1-11,17H
InChI Key:
ODWKRPCIBXUXDY-UHFFFAOYSA-N
SMILES:
O/C(=C\C(=O)c1ccccc1)/C=C/c1ccco1
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.079g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.258g/mol
Monoisotopic Mass:
240.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
3.2
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