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4-(4-nitrophenyl)-1H-pyrazole

4-(4-nitrophenyl)-1H-pyrazole structure

CAS No:
114474-26-9
Formula:
C9H7N3O2
Chemical Name:
4-(4-nitrophenyl)-1H-pyrazole

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4-(4-nitrophenyl)-1H-pyrazole Basic Attributes

Molecular Weight：

189.17100

Exact Mass：

189.053826475

DSSTox ID：

DTXSID40375542

HScode：

2933199090

Characteristics

PSA：

74.50000

XLogP3：

2.50810

Density：

1.184g/cm3

Melting Point：

80-83ºC

Boiling Point：

419.3ºC at 760mmHg

Flash Point：

207.4ºC

Refractive Index：

1.55

Vapor Pressure：

3.07E-07mmHg at 25°C

Safety Information

Marks：

GHS Classification：

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:189.17
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:189.053826475
Monoisotopic Mass:189.053826475
Topological Polar Surface Area:74.5
Heavy Atom Count:14
Complexity:209
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(4-nitrophenyl)-1H-pyrazole

Basic Attributes
Characteristics
Safety Information
Computed Properties

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