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4-bromo-2,6-dimethylbenzenecarbonitrile

4-bromo-2,6-dimethylbenzenecarbonitrile structure

CAS No:
5757-66-4
Formula:
C9H8BrN
Chemical Name:
4-bromo-2,6-dimethylbenzenecarbonitrile
Synonyms:
4-bromo-2,6-dimethylbenzonitrile;4-bromo-2,6-dimethylbenzenecarbonitrile;4-bromo-2,6-dimethyl-benzonitrile;Benzonitrile,4-bromo-2,6-dimethyl-;SCHEMBL145353;AMBZ0025;CTK5A7092;KS-00002AYY;DTXSID10448070;4-bromo-2,6-dimethylben-zonitrile

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4-bromo-2,6-dimethylbenzenecarbonitrile Basic Attributes

Molecular Weight：

210.070

Exact Mass：

208.984009

DSSTox ID：

DTXSID10448070

HScode：

2926909090

Characteristics

PSA：

23.79000

XLogP3：

3.34

Density：

1.4±0.1 g/cm3

Melting Point：

71-72 °C

Boiling Point：

279.8±35.0 °C at 760 mmHg

Flash Point：

123.0±25.9 °C

Refractive Index：

1.579

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:210.07
XLogP3:3.1
Hydrogen Bond Acceptor Count:1
Exact Mass:208.98401
Monoisotopic Mass:208.98401
Topological Polar Surface Area:23.8
Heavy Atom Count:11
Complexity:169
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-bromo-2,6-dimethylbenzenecarbonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-bromo-2,6-dimethylbenzenecarbonitrile

SDS

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