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Home > Nitro Compounds > 62882-07-9
62882-07-9 | 2-(2-nitrophenyl)-1,3-oxazole
CAS No: 62882-07-9 Catalog No: AG01B65F MDL No:MFCD15527551
Product Description
Catalog Number:
AG01B65F
Chemical Name:
2-(2-nitrophenyl)-1,3-oxazole
CAS Number:
62882-07-9
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
MDL Number:
MFCD15527551
IUPAC Name:
2-(2-nitrophenyl)-1,3-oxazole
InChI:
InChI=1S/C9H6N2O3/c12-11(13)8-4-2-1-3-7(8)9-10-5-6-14-9/h1-6H
InChI Key:
JWLIPOOAITVBES-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1c1ncco1
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.038g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.158g/mol
Monoisotopic Mass:
190.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Estimation of the hydrophobicity of 2,4-diphenyl-1,3-oxazoline analogs and QSAR analysis of their ovicidal activity against Tetranychus [corrected] urticae. | Bioorganic & medicinal chemistry letters 20060801 |
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