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2-(2-methyl-5-nitrophenyl)acetonitrile

2-(2-methyl-5-nitrophenyl)acetonitrile structure

CAS No:
409082-11-7
Formula:
C9H8N2O2
Chemical Name:
2-(2-methyl-5-nitrophenyl)acetonitrile

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2-(2-methyl-5-nitrophenyl)acetonitrile Basic Attributes

Molecular Weight：

176.17200

Exact Mass：

176.058577502

DSSTox ID：

DTXSID00625919

HScode：

2926909090

Characteristics

PSA：

69.61000

XLogP3：

2.49248

Density：

1.226 g/cm3

Boiling Point：

361.613ºC at 760 mmHg

Flash Point：

172.498ºC

Computed Properties

Molecular Weight:176.17
XLogP3:2.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:176.058577502
Monoisotopic Mass:176.058577502
Topological Polar Surface Area:69.6
Heavy Atom Count:13
Complexity:238
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(2-methyl-5-nitrophenyl)acetonitrile

Basic Attributes
Characteristics
Computed Properties

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