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37040-51-0 | (Z)-(1-methyl-1H-imidazol-2-yl)(4-nitrophenyl)methanone oxime
CAS No: 37040-51-0 Catalog No: AG00JH2L MDL No:MFCD07658203
Product Description
Catalog Number:
AG00JH2L
Chemical Name:
(Z)-(1-methyl-1H-imidazol-2-yl)(4-nitrophenyl)methanone oxime
CAS Number:
37040-51-0
Molecular Formula:
C11H10N4O3
Molecular Weight:
246.2221
MDL Number:
MFCD07658203
IUPAC Name:
(NZ)-N-[(1-methylimidazol-2-yl)-(4-nitrophenyl)methylidene]hydroxylamine
InChI:
InChI=1S/C11H10N4O3/c1-14-7-6-12-11(14)10(13-16)8-2-4-9(5-3-8)15(17)18/h2-7,16H,1H3/b13-10-
InChI Key:
UBFIBGGMSWQPDE-RAXLEYEMSA-N
SMILES:
O/N=C(\c1nccn1C)/c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
246.075g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.226g/mol
Monoisotopic Mass:
246.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
96.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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