3-Chloro-2-methylpropanenitrile
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3-Chloro-2-methylpropanenitrile
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CAS No:
7659-45-2
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Formula:
C4H6ClN
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Chemical Name:
3-Chloro-2-methylpropanenitrile
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Synonyms:
Propanenitrile,3-chloro-2-methyl-;Propionitrile,3-chloro-2-methyl-;3-Chloro-2-methylpropanenitrile;3-Chloro-2-methylpropionitrile;2-Methyl-3-chloropropionitrile;NSC 97379
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CAS No:
Characteristics
23.79000
1.38488
1.6041 g/cm3 @ Temp: 13.8 °C
51.5-52.5 °C @ Press: 6 Torr
142 °F
n20/D 1.434(lit.)
Safety Information
UN 3276 6.1/PG 3
3
20/21/22
16-26-27-36/37/39
Xn
P280
H302 + H312 + H332
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|Aggregated GHS information provided by 73 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:103.55
XLogP3:1.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:103.0188769
Monoisotopic Mass:103.0188769
Topological Polar Surface Area:23.8
Heavy Atom Count:6
Complexity:70.9
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes