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N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-nitro-N-propan-2-ylbenzamide

N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-nitro-N-propan-2-ylbenzamide structure

CAS No:
5550-99-2
Formula:
C21H22N4O4
Chemical Name:
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-nitro-N-propan-2-ylbenzamide

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N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-nitro-N-propan-2-ylbenzamide Basic Attributes

Molecular Weight：

394.42400

Exact Mass：

394.16410520

DSSTox ID：

DTXSID40362093

HScode：

2928000090

Characteristics

PSA：

93.06000

XLogP3：

3.97100

Density：

1.33g/cm3

Boiling Point：

549.2ºC at 760 mmHg

Flash Point：

285.9ºC

Refractive Index：

1.652

Computed Properties

Molecular Weight:394.4
XLogP3:3.8
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:394.16410520
Monoisotopic Mass:394.16410520
Topological Polar Surface Area:89.7
Heavy Atom Count:29
Complexity:685
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-nitro-N-propan-2-ylbenzamide

Basic Attributes
Characteristics
Computed Properties

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