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4(7)-NITROBENZIMIDAZOLE

4(7)-NITROBENZIMIDAZOLE structure

CAS No:
10597-52-1
Formula:
C7H5N3O2
Chemical Name:
4(7)-NITROBENZIMIDAZOLE
Synonyms:
4-nitro-1h-benzimidazol;4-nitro-benzimidazol;4-NITRO-1H-BENZIMIDAZOLE;4-NITROBENZIMIDAZOLE;4(7)-NITROBENZIMIDAZOLE;4-Nitro-1H-benzoimidazole;1H-Benzimidazole,4-nitro-(9CI);4-nitro-1H-benzo[d]iMidazole

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4(7)-NITROBENZIMIDAZOLE Basic Attributes

Molecular Weight：

163.13

Exact Mass：

163.13

DSSTox ID：

DTXSID00147449

HScode：

2933998090

Characteristics

PSA：

74.50000

XLogP3：

1.99430

Density：

1.525±0.06 g/cm3(Predicted)

Melting Point：

238-239 °C

Boiling Point：

475.7±18.0 °C(Predicted)

Flash Point：

241.5ºC

Refractive Index：

1.74

Vapor Pressure：

9.35E-09mmHg at 25°C

PKA：

9.21±0.30(Predicted)

Critical Temperature & Pressure：

2-8°C

Computed Properties

Molecular Weight:163.13
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:163.038176411
Monoisotopic Mass:163.038176411
Topological Polar Surface Area:74.5
Heavy Atom Count:12
Complexity:192
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4(7)-NITROBENZIMIDAZOLE

Basic Attributes
Characteristics
Computed Properties

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