2,3-Dibromopropionitrile
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2,3-Dibromopropionitrile
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CAS No:
4554-16-9
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Formula:
C3H3Br2N
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Chemical Name:
2,3-Dibromopropionitrile
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Synonyms:
Propanenitrile,2,3-dibromo-;Propionitrile,2,3-dibromo-;2,3-Dibromopropanenitrile;2,3-Dibromopropionitrile;α,β-Dibromopropionitrile;2,3-Dibromopropanonitrile;159789-09-0
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CAS No:
Characteristics
23.79000
1.66838
2.174 g/cm3 @ Temp: 20 °C
131-132 °C
106-107 °C @ Press: 22 Torr
172°F
1.545
Safety Information
R22/21/22;R36/37/38
S26-S36/37
Xn:Harmful;
P264, P270, P301+P310, P321, P330, P405, P501
H300
|Warning|H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|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 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Danger|H300: Fatal if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501
2,3-Dibromopropionitrile Use and Manufacturing
2,3-Dibromopropionitrile is a useful and versatile synthetic reagent is organic synthesis. 2,3-Dibromopropionitrile is also a potential halogenated drinking water byproduct.
Propanenitrile, 2,3-dibromo-: ACTIVE
Computed Properties
Molecular Weight:212.87
XLogP3:1.6
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:212.86117
Monoisotopic Mass:210.86322
Topological Polar Surface Area:23.8
Heavy Atom Count:6
Complexity:72.1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes