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Home > Nitro Compounds > 5198-51-6
5198-51-6 | 3-(3-nitrophenyl)-1,3-oxazolidin-2-one
CAS No: 5198-51-6 Catalog No: AG019UAC MDL No:MFCD11839756
Product Description
Catalog Number:
AG019UAC
Chemical Name:
3-(3-nitrophenyl)-1,3-oxazolidin-2-one
CAS Number:
5198-51-6
Molecular Formula:
C9H8N2O4
Molecular Weight:
208.1708
MDL Number:
MFCD11839756
IUPAC Name:
3-(3-nitrophenyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C9H8N2O4/c12-9-10(4-5-15-9)7-2-1-3-8(6-7)11(13)14/h1-3,6H,4-5H2
InChI Key:
DIAJMQOAAXLQTP-UHFFFAOYSA-N
SMILES:
O=C1OCCN1c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.048g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.173g/mol
Monoisotopic Mass:
208.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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