2-ISOPROPYL-2-PHENYLACETONITRILE
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2-ISOPROPYL-2-PHENYLACETONITRILE
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CAS No:
5558-29-2
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Formula:
C11H13N
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Chemical Name:
2-ISOPROPYL-2-PHENYLACETONITRILE
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Synonyms:
TIMTEC-BB SBB008509;2-PHENYLISOVALERONITRILE;3-METHYL-2-PHENYLBUTYRONITRILE;3-METHYL-2-PHENYLBUTANENITRILE;A-(ISO-PROPYL)PHENYLACETONITRILE;2-ISOPROPYL-2-PHENYLACETONITRILE;^a-Isopropylphenylacetonitrile 97%;alpha-(iso-Propyl)phenylacetonitrile;alpha-Isopropylphenylacetonitrile 97%;Isopropyl(phenyl)acetonitrile, alpha-Isopropylbenzyl cyanide
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CAS No:
Safety Information
III
6.1
UN 3276
20/21/22
26-36/37/39
T
P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501
H301
|Danger|H301 (83.33%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, 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 6 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:159.23
XLogP3:2.3
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:159.104799419
Monoisotopic Mass:159.104799419
Topological Polar Surface Area:23.8
Heavy Atom Count:12
Complexity:169
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
2-ISOPROPYL-2-PHENYLACETONITRILE
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