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30992-75-7 | 2H-1-Benzopyran-2-one, 4,6-dihydroxy-
CAS No: 30992-75-7 Catalog No: AG0031VE MDL No:MFCD00464231
Product Description
Catalog Number:
AG0031VE
Chemical Name:
2H-1-Benzopyran-2-one, 4,6-dihydroxy-
CAS Number:
30992-75-7
Molecular Formula:
C9H6O4
Molecular Weight:
178.1415
MDL Number:
MFCD00464231
IUPAC Name:
4,6-dihydroxychromen-2-one
InChI:
InChI=1S/C9H6O4/c10-5-1-2-8-6(3-5)7(11)4-9(12)13-8/h1-4,10-11H
InChI Key:
ORMYACLDZGAWNY-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)c(O)cc(=O)o2
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.027g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
178.143g/mol
Monoisotopic Mass:
178.027g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Literature
| Title | Journal |
|---|---|
| Formation of coumarines during the degradation of alkyl substituted aromatic oil components by the yeast Trichosporon asahii. | Applied microbiology and biotechnology 20091001 |
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