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4-(2-formylpyrrol-1-yl)benzonitrile

4-(2-formylpyrrol-1-yl)benzonitrile structure

CAS No:
169036-66-2
Formula:
C12H8N2O
Chemical Name:
4-(2-formylpyrrol-1-yl)benzonitrile
Synonyms:
4-(2-formyl-1H-pyrrol-1-yl)benzonitrile;

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4-(2-formylpyrrol-1-yl)benzonitrile Basic Attributes

Molecular Weight：

196.20500

Exact Mass：

196.063662883

DSSTox ID：

DTXSID70378223

HScode：

2933990090

Characteristics

PSA：

45.79000

XLogP3：

2.16148

Density：

1.13g/cm3

Boiling Point：

384ºC

Flash Point：

186ºC

Refractive Index：

1.601

Vapor Pressure：

4.23E-06mmHg at 25°C

Computed Properties

Molecular Weight:196.20
XLogP3:1.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:196.063662883
Monoisotopic Mass:196.063662883
Topological Polar Surface Area:45.8
Heavy Atom Count:15
Complexity:273
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(2-formylpyrrol-1-yl)benzonitrile

Basic Attributes
Characteristics
Computed Properties

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