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2-[3-(cyanomethyl)-2-oxobenzimidazol-1-yl]acetonitrile

2-[3-(cyanomethyl)-2-oxobenzimidazol-1-yl]acetonitrile structure

CAS No:
73688-74-1
Formula:
C11H8N4O
Chemical Name:
2-[3-(cyanomethyl)-2-oxobenzimidazol-1-yl]acetonitrile
Synonyms:
1,3-Benzimidazolinediacetonitrile,2-oxo; 2-Benzimidazole-1,3-diacetonitrile; 2-Oxo-1,3-benzimidazolinediacetonitrile;

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2-[3-(cyanomethyl)-2-oxobenzimidazol-1-yl]acetonitrile Basic Attributes

Molecular Weight：

212.20700

Exact Mass：

212.06981089

DSSTox ID：

DTXSID70223966

Characteristics

PSA：

74.51000

XLogP3：

0.85016

Density：

1.334g/cm3

Boiling Point：

418.6ºC

Flash Point：

207ºC

Refractive Index：

1.607

Computed Properties

Molecular Weight:212.21
XLogP3:0.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:212.06981089
Monoisotopic Mass:212.06981089
Topological Polar Surface Area:71.1
Heavy Atom Count:16
Complexity:351
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[3-(cyanomethyl)-2-oxobenzimidazol-1-yl]acetonitrile

Basic Attributes
Characteristics
Computed Properties

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