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7338-51-4 | 7-Hydroxy-5-methoxy-2-methyl-4-oxo-4H-1-benzopyran-6-carboxaldehyde
CAS No: 7338-51-4 Catalog No: AG005OCG MDL No:
Product Description
Catalog Number:
AG005OCG
Chemical Name:
7-Hydroxy-5-methoxy-2-methyl-4-oxo-4H-1-benzopyran-6-carboxaldehyde
CAS Number:
7338-51-4
Molecular Formula:
C12H10O5
Molecular Weight:
234.2048
IUPAC Name:
7-hydroxy-5-methoxy-2-methyl-4-oxochromene-6-carbaldehyde
InChI:
InChI=1S/C12H10O5/c1-6-3-9(15)11-10(17-6)4-8(14)7(5-13)12(11)16-2/h3-5,14H,1-2H3
InChI Key:
HAYPHUYUTZEJQC-UHFFFAOYSA-N
SMILES:
COc1c(C=O)c(O)cc2c1c(=O)cc(o2)C
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.053g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.207g/mol
Monoisotopic Mass:
234.053g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Literature
| Title | Journal |
|---|---|
| Microplate assay for screening the antibacterial activity of Schiff bases derived from substituted benzopyran-4-one. | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120901 |
| Synthesis, spectral, thermal and magnetic studies of Mn(II), Ni(II) and Cu(II) complexes with some benzopyran-4-one Schiff bases. | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20110801 |
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