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Home > Other Building Blocks > 115713-42-3
115713-42-3 | 4H-1-Benzopyran-4-one, 8-methoxy-2-(2-methoxyphenyl)-
CAS No: 115713-42-3 Catalog No: AG000GRP MDL No:
Product Description
Catalog Number:
AG000GRP
Chemical Name:
4H-1-Benzopyran-4-one, 8-methoxy-2-(2-methoxyphenyl)-
CAS Number:
115713-42-3
Molecular Formula:
C17H14O4
Molecular Weight:
282.2907
IUPAC Name:
8-methoxy-2-(2-methoxyphenyl)chromen-4-one
InChI:
InChI=1S/C17H14O4/c1-19-14-8-4-3-6-12(14)16-10-13(18)11-7-5-9-15(20-2)17(11)21-16/h3-10H,1-2H3
InChI Key:
ZLUNDKGGMHFJPK-UHFFFAOYSA-N
SMILES:
COc1ccccc1c1cc(=O)c2c(o1)c(OC)ccc2
Properties
Complexity:
417
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.089g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.295g/mol
Monoisotopic Mass:
282.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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