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1-(3-NITRO-4-PIPERIDINOPHENYL)-1-ETHANONE

1-(3-NITRO-4-PIPERIDINOPHENYL)-1-ETHANONE structure

CAS No:
30877-80-6
Formula:
C13H16N2O3
Chemical Name:
1-(3-NITRO-4-PIPERIDINOPHENYL)-1-ETHANONE
Synonyms:
1-(3-NITRO-4-PIPERIDINOPHENYL)-1-ETHANONE;3-NITRO-4-(1-PIPERIDINO)ACETOPHENONE;1-(3-Nitro-4-piperidin-1-ylphenyl)ethanone;1-(3-nitro-4-piperidino-phenyl)ethanone;1-[3-nitro-4-(1-piperidyl)phenyl]ethanone;Ethanone, 1-[3-nitro-4-(1-piperidinyl)phenyl]-

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1-(3-NITRO-4-PIPERIDINOPHENYL)-1-ETHANONE Basic Attributes

Molecular Weight：

248.28

Exact Mass：

248.11609238

DSSTox ID：

DTXSID80377348

Characteristics

Density：

1.210±0.06 g/cm3

Melting Point：

90.5-91.5 °C(Solv: ethanol (64-17-5))

Boiling Point：

394.6±32.0 °C(Predicted)

PKA：

1.15±0.40

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:248.28
XLogP3:2.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:248.11609238
Monoisotopic Mass:248.11609238
Topological Polar Surface Area:66.1
Heavy Atom Count:18
Complexity:321
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(3-NITRO-4-PIPERIDINOPHENYL)-1-ETHANONE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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