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3-nitro-1-(2-oxo-2-phenylethyl)pyridin-2(1{H})-one

3-nitro-1-(2-oxo-2-phenylethyl)pyridin-2(1{H})-one structure

CAS No:
367454-75-9
Formula:
C13H10N2O4
Chemical Name:
3-nitro-1-(2-oxo-2-phenylethyl)pyridin-2(1{H})-one
Synonyms:
3-nitro-1-(2-oxo-2-phenylethyl)pyridin-2(1{H})-one;2(1H)-Pyridinone, 3-nitro-1-(2-oxo-2-phenylethyl)-

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3-nitro-1-(2-oxo-2-phenylethyl)pyridin-2(1{H})-one Basic Attributes

Molecular Weight：

258.23

Exact Mass：

258.06405680 g/mol

Characteristics

PSA：

83.2 Å²

Density：

1.39±0.1 g/cm3

Melting Point：

143-144 °C (decomp)

Boiling Point：

484.1±45.0 °C(Predicted)

PKA：

-5.66±0.70

Computed Properties

Molecular Weight:258.23
XLogP3:1.8
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:258.06405680
Monoisotopic Mass:258.06405680
Topological Polar Surface Area:83.2
Heavy Atom Count:19
Complexity:456
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-nitro-1-(2-oxo-2-phenylethyl)pyridin-2(1{H})-one

Basic Attributes
Characteristics
Computed Properties

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