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Home > Nitro Compounds > 698379-18-9
698379-18-9 | Benzoxazole, 2-(2-methoxyphenyl)-6-nitro-
CAS No: 698379-18-9 Catalog No: AG005TK4 MDL No:
Product Description
Catalog Number:
AG005TK4
Chemical Name:
Benzoxazole, 2-(2-methoxyphenyl)-6-nitro-
CAS Number:
698379-18-9
Molecular Formula:
C14H10N2O4
Molecular Weight:
270.2402
IUPAC Name:
2-(2-methoxyphenyl)-6-nitro-1,3-benzoxazole
InChI:
InChI=1S/C14H10N2O4/c1-19-12-5-3-2-4-10(12)14-15-11-7-6-9(16(17)18)8-13(11)20-14/h2-8H,1H3
InChI Key:
UFOUARFMCFYGOE-UHFFFAOYSA-N
SMILES:
COc1ccccc1c1nc2c(o1)cc(cc2)[N+](=O)[O-]
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.064g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.244g/mol
Monoisotopic Mass:
270.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Some fused heterocyclic compounds as eukaryotic topoisomerase II inhibitors. | Biochemical and biophysical research communications 20040430 |
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