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2-BUTYL-1H-IMIDAZOLE-4,5-DICARBONITRILE

2-BUTYL-1H-IMIDAZOLE-4,5-DICARBONITRILE structure

CAS No:
114772-25-7
Formula:
C9H10N4
Chemical Name:
2-BUTYL-1H-IMIDAZOLE-4,5-DICARBONITRILE
Synonyms:
2-butyl-1H-imidazole-4,5-dicarbonitrile;2-Butylimidazole-4,5-dicarbonitrile;1H-Imidazole-4,5-dicarbonitrile,2-butyl-;ACMC-20dyor;SCHEMBL795;MLS000763514;2-Butyl-4,5-dicyanoimidazole;CHEMBL1350335;2-n-butyl-4,5-dicyanoimidazole;CTK4A8890

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2-BUTYL-1H-IMIDAZOLE-4,5-DICARBONITRILE Basic Attributes

Molecular Weight：

174.2

Exact Mass：

174.09100

DSSTox ID：

DTXSID80413972

HScode：

2933290090

Characteristics

PSA：

76.3

XLogP3：

1.49566

Density：

1.17g/cm3

Melting Point：

107-108°

Boiling Point：

478.8ºC at 760mmHg

Flash Point：

151.1ºC

Refractive Index：

1.535

Water Solubility：

>26.1 [ug/mL]

Vapor Pressure：

2.5E-09mmHg at 25°C

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:174.20
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:174.090546336
Monoisotopic Mass:174.090546336
Topological Polar Surface Area:76.3
Heavy Atom Count:13
Complexity:255
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-BUTYL-1H-IMIDAZOLE-4,5-DICARBONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties

2-BUTYL-1H-IMIDAZOLE-4,5-DICARBONITRILE

SDS

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