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Home > Nitro Compounds > 1197903-17-5
1197903-17-5 | 1-(4-Nitro-phenyl)-piperidin-4-one O-methyl-oxime
CAS No: 1197903-17-5 Catalog No: AG00JSA8 MDL No:
Product Description
Catalog Number:
AG00JSA8
Chemical Name:
1-(4-Nitro-phenyl)-piperidin-4-one O-methyl-oxime
CAS Number:
1197903-17-5
Molecular Formula:
C12H15N3O3
Molecular Weight:
249.2658
IUPAC Name:
N-methoxy-1-(4-nitrophenyl)piperidin-4-imine
InChI:
InChI=1S/C12H15N3O3/c1-18-13-10-6-8-14(9-7-10)11-2-4-12(5-3-11)15(16)17/h2-5H,6-9H2,1H3
InChI Key:
FKTLHMMEFQBZIG-UHFFFAOYSA-N
SMILES:
CON=C1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.111g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.27g/mol
Monoisotopic Mass:
249.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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