4-Bromo-2-methylbenzonitrile
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4-Bromo-2-methylbenzonitrile
structure -
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CAS No:
67832-11-5
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Formula:
C8H6BrN
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Chemical Name:
4-Bromo-2-methylbenzonitrile
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Synonyms:
TIMTEC-BB SBB005832;4-BROMO-2-METHYLBENZONITRILE;4-Bromo-2-Methylbenzonitrile97%;4-Bromo-2-methylbenzonitrile ,98%;5-Bromo-2-cyanotoluene, 4-Bromo-o-tolunitrile;4-Bromo-2-methylbenzonitrile 97%
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CAS No:
4-Bromo-2-methylbenzonitrile Basic Attributes
196.04
194.968353
2574103
229305
DTXSID30218075
2926909090
Characteristics
23.8
2.7
white to slightly yellow powder
1.5±0.1 g/cm3
65-69 °C
259°C at 760 mmHg
110.4±21.8 °C
1.591
H2O: insoluble
Safety Information
III
6.1
3439
3
22-36/37/38-20/21/22
36/37/39-26-22-37/39
Xn,Xi
P305 + P351 + P338
H302-H319
|Warning|H302 (95.65%): 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|Aggregated GHS information provided by 46 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:196.04
XLogP3:2.7
Hydrogen Bond Acceptor Count:1
Exact Mass:194.96836
Monoisotopic Mass:194.96836
Topological Polar Surface Area:23.8
Heavy Atom Count:10
Complexity:158
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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