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Home > Other Building Blocks > 19225-17-3
19225-17-3 | 2H-1-Benzopyran-2-one, 4,7-dihydroxy-3-phenyl-
CAS No: 19225-17-3 Catalog No: AG002FSY MDL No:MFCD01731806
Product Description
Catalog Number:
AG002FSY
Chemical Name:
2H-1-Benzopyran-2-one, 4,7-dihydroxy-3-phenyl-
CAS Number:
19225-17-3
Molecular Formula:
C15H10O4
Molecular Weight:
254.2375
MDL Number:
MFCD01731806
IUPAC Name:
4,7-dihydroxy-3-phenylchromen-2-one
InChI:
InChI=1S/C15H10O4/c16-10-6-7-11-12(8-10)19-15(18)13(14(11)17)9-4-2-1-3-5-9/h1-8,16-17H
InChI Key:
APFWLFUGBMRXCS-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)oc(=O)c(c2O)c1ccccc1
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.058g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
254.241g/mol
Monoisotopic Mass:
254.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Structure-activity relationships of some 3-substituted-4-hydroxycoumarins as HIV-1 protease inhibitors. | Farmaco (Societa chimica italiana : 1989) 20020901 |
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