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101910-60-5 | 2H-1-Benzopyran-2-one, 3-[(2-oxo-2H-1-benzopyran-7-yl)oxy]-
CAS No: 101910-60-5 Catalog No: AG0005WY MDL No:
Product Description
Catalog Number:
AG0005WY
Chemical Name:
2H-1-Benzopyran-2-one, 3-[(2-oxo-2H-1-benzopyran-7-yl)oxy]-
CAS Number:
101910-60-5
Molecular Formula:
C18H10O5
Molecular Weight:
306.2690
IUPAC Name:
3-(2-oxochromen-7-yl)oxychromen-2-one
InChI:
InChI=1S/C18H10O5/c19-17-8-6-11-5-7-13(10-15(11)22-17)21-16-9-12-3-1-2-4-14(12)23-18(16)20/h1-10H
InChI Key:
ULEVTTAWAZPTOO-UHFFFAOYSA-N
SMILES:
O=c1ccc2c(o1)cc(cc2)Oc1cc2ccccc2oc1=O
Properties
Complexity:
564
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.053g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.273g/mol
Monoisotopic Mass:
306.053g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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