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Technical details about 1,2-Cyclohexanedione Dioxime, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as:
Molecular Formula
C6H10N2O2
Molecular Weight
142.16  g/mol
InChI Key
IGRLVVLCDUAJSB-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N-(2-nitrosocyclohexen-1-yl)hydroxylamine
2.1.2 InChI
InChI=1S/C6H10N2O2/c9-7-5-3-1-2-4-6(5)8-10/h7,9H,1-4H2
2.1.3 InChI Key
IGRLVVLCDUAJSB-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CCC(=C(C1)NO)N=O
2.2 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 142.16 g/mol
Molecular Formula C6H10N2O2
XLogP30.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass142.074227566 g/mol
Monoisotopic Mass142.074227566 g/mol
Topological Polar Surface Area61.7 Ų
Heavy Atom Count10
Formal Charge0
Complexity165
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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