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Ethanone,1-[2-(butylamino)-5-nitrophenyl]-

Ethanone,1-[2-(butylamino)-5-nitrophenyl]- structure

CAS No:
1187396-03-7
Formula:
C12H16N2O3
Chemical Name:
Ethanone,1-[2-(butylamino)-5-nitrophenyl]-
Synonyms:
Ethanone, 1-[2-(butylamino)-5-nitrophenyl]-;1-[2-(butylamino)-5-nitrophenyl]ethanone

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Ethanone,1-[2-(butylamino)-5-nitrophenyl]- Basic Attributes

Molecular Weight：

236.27

Exact Mass：

236.116

Characteristics

PSA：

74.92

XLogP3：

3.6056

Density：

1.170±0.06 g/cm3

Melting Point：

46.8-48.3 °C

Boiling Point：

358.8±32.0 °C(Predicted)

PKA：

-1.07±0.32

Computed Properties

Molecular Weight:236.27
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:236.11609238
Monoisotopic Mass:236.11609238
Topological Polar Surface Area:74.9
Heavy Atom Count:17
Complexity:275
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ethanone,1-[2-(butylamino)-5-nitrophenyl]-

Basic Attributes
Characteristics
Computed Properties

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