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23670-24-8 | 2(3H)-Benzofuranone, 3-(3-methoxy-5-oxo-4-phenyl-2(5H)-furylidene)- (8CI)
CAS No: 23670-24-8 Catalog No: AG002O37 MDL No:
Product Description
Catalog Number:
AG002O37
Chemical Name:
2(3H)-Benzofuranone, 3-(3-methoxy-5-oxo-4-phenyl-2(5H)-furylidene)- (8CI)
CAS Number:
23670-24-8
Molecular Formula:
C19H12O5
Molecular Weight:
320.2956
IUPAC Name:
3-(3-methoxy-5-oxo-4-phenylfuran-2-ylidene)-1-benzofuran-2-one
InChI:
InChI=1S/C19H12O5/c1-22-16-14(11-7-3-2-4-8-11)18(20)24-17(16)15-12-9-5-6-10-13(12)23-19(15)21/h2-10H,1H3
InChI Key:
ZELGBELYWRSUSX-UHFFFAOYSA-N
SMILES:
COC1=C(c2ccccc2)C(=O)OC1=C1C(=O)Oc2c1cccc2
Properties
Complexity:
624
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.068g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
320.3g/mol
Monoisotopic Mass:
320.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3
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