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4-(Diethylamino)benzonitrile

4-(Diethylamino)benzonitrile structure

CAS No:
2873-90-7
Formula:
C11H14N2
Chemical Name:
4-(Diethylamino)benzonitrile
Synonyms:
Benzonitrile,4-(diethylamino)-;Benzonitrile,p-(diethylamino)-;4-(Diethylamino)benzonitrile;4-(Diethylamino)benzenecarbonitrile;N,N-Diethyl-p-cyanoaniline;p-Cyano-N,N-diethylaniline;p-(Diethylamino)benzonitrile;4-(N,N-Diethylamino)benzonitrile;4-(Diethylamino)benzenenitrile;NSC 32450

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4-(Diethylamino)benzonitrile Basic Attributes

Molecular Weight：

174.24200

Exact Mass：

174.24

EC Number：

220-712-7

NSC Number：

32450

DSSTox ID：

DTXSID90182889

HScode：

2926909090

Characteristics

PSA：

27.03000

XLogP3：

2.40448

Density：

1.01 g/cm3

Melting Point：

66-67 °C

Boiling Point：

341.8ºC at 760 mmHg

Flash Point：

151.4ºC

Refractive Index：

1.536

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN 3276

hazard class code：

R20/21/22

safety instructions：

S22-S36/37

Marks：

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, P501

Hazard Statements：

H302

GHS Classification：

|Danger|H301+H311+H331 (20%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 5 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:174.24
XLogP3:2.9
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:174.115698455
Monoisotopic Mass:174.115698455
Topological Polar Surface Area:27
Heavy Atom Count:13
Complexity:180
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(Diethylamino)benzonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-(Diethylamino)benzonitrile

SDS

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