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4-FORMYL-3-NITROBENZONITRILE

4-FORMYL-3-NITROBENZONITRILE structure

CAS No:
90178-78-2
Formula:
C8H4N2O3
Chemical Name:
4-FORMYL-3-NITROBENZONITRILE
Synonyms:
4-formyl-3-nitrobenzonitrile;BENZONITRILE, 4-FORMYL-3-NITRO-;4-cyano-2-nitrobenzaldehyde;SCHEMBL125038;4-formyl-3-nitro-benzonitrile;CTK8C1018;DTXSID70531098;4989AC;ANW-65732;ZINC39432008

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4-FORMYL-3-NITROBENZONITRILE Basic Attributes

Molecular Weight：

176.131

Exact Mass：

176.022186

DSSTox ID：

DTXSID70531098

HScode：

2926909090

Characteristics

PSA：

86.7

XLogP3：

Density：

1.4±0.1 g/cm3

Boiling Point：

354.6°C at 760 mmHg

Flash Point：

168.3±26.5 °C

Refractive Index：

1.589

Computed Properties

Molecular Weight:176.13
XLogP3:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:176.02219199
Monoisotopic Mass:176.02219199
Topological Polar Surface Area:86.7
Heavy Atom Count:13
Complexity:262
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-FORMYL-3-NITROBENZONITRILE

Basic Attributes
Characteristics
Computed Properties

4-FORMYL-3-NITROBENZONITRILE

SDS

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