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1150-59-0 | 1,4-Naphthalenedione, 2-hydroxy-3-phenyl-
CAS No: 1150-59-0 Catalog No: AG000FLA MDL No:
Product Description
Catalog Number:
AG000FLA
Chemical Name:
1,4-Naphthalenedione, 2-hydroxy-3-phenyl-
CAS Number:
1150-59-0
Molecular Formula:
C16H10O3
Molecular Weight:
250.2488
IUPAC Name:
4-hydroxy-3-phenylnaphthalene-1,2-dione
InChI:
InChI=1S/C16H10O3/c17-14-11-8-4-5-9-12(11)15(18)16(19)13(14)10-6-2-1-3-7-10/h1-9,17H
InChI Key:
HCKUADBGJIXWTR-UHFFFAOYSA-N
SMILES:
OC1=C(c2ccccc2)C(=O)c2c(C1=O)cccc2
NSC Number:
102533
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.063g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.253g/mol
Monoisotopic Mass:
250.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Biological evaluation of hydroxynaphthoquinones as anti-malarials. | Malaria journal 20130101 |
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