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2-Nitro-5-(1-piperidinyl)benzonitrile

2-Nitro-5-(1-piperidinyl)benzonitrile structure

CAS No:
13514-94-8
Formula:
C12H13N3O2
Chemical Name:
2-Nitro-5-(1-piperidinyl)benzonitrile
Synonyms:
Benzonitrile,2-nitro-5-(1-piperidinyl)-;Benzonitrile,2-nitro-5-piperidino-;2-Nitro-5-(1-piperidinyl)benzonitrile;2-Nitro-5-piperidinobenzonitrile;NSC 263788

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2-Nitro-5-(1-piperidinyl)benzonitrile Basic Attributes

Molecular Weight：

231.25100

Exact Mass：

231.25

NSC Number：

263788

DSSTox ID：

DTXSID00312877

Characteristics

PSA：

72.85000

XLogP3：

3.04498

Density：

1.27g/cm3

Melting Point：

129-130 °C

Boiling Point：

441.3ºC at 760 mmHg

Flash Point：

220.7ºC

Refractive Index：

1.602

Vapor Pressure：

5.48E-08mmHg at 25°C

Computed Properties

Molecular Weight:231.25
XLogP3:2.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:231.100776666
Monoisotopic Mass:231.100776666
Topological Polar Surface Area:72.8
Heavy Atom Count:17
Complexity:324
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Nitro-5-(1-piperidinyl)benzonitrile

Basic Attributes
Characteristics
Computed Properties

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