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1-[2-(Isopropylamino)-5-nitrophenyl]ethanone

1-[2-(Isopropylamino)-5-nitrophenyl]ethanone structure

CAS No:
1187396-04-8
Formula:
C11H14N2O3
Chemical Name:
1-[2-(Isopropylamino)-5-nitrophenyl]ethanone
Synonyms:
1-[2-(Isopropylamino)-5-nitrophenyl]ethanone;Ethanone, 1-[2-[(1-methylethyl)amino]-5-nitrophenyl]-

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1-[2-(Isopropylamino)-5-nitrophenyl]ethanone Basic Attributes

Molecular Weight：

222.24

Exact Mass：

222.1

Characteristics

PSA：

74.92

XLogP3：

3.2139

Density：

1?+-.0.06 g/cm3

Melting Point：

68.3-71.4 °C

Boiling Point：

338.4±32.0 °C(Predicted)

PKA：

-0.30±0.32

Computed Properties

Molecular Weight:222.24
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:222.10044231
Monoisotopic Mass:222.10044231
Topological Polar Surface Area:74.9
Heavy Atom Count:16
Complexity:273
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[2-(Isopropylamino)-5-nitrophenyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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