(2E)-3-Methyl-5-phenyl-2-pentenenitrile
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(2E)-3-Methyl-5-phenyl-2-pentenenitrile
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CAS No:
53243-60-0
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Formula:
C12H13N
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Chemical Name:
(2E)-3-Methyl-5-phenyl-2-pentenenitrile
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Synonyms:
2-Pentenenitrile,3-methyl-5-phenyl-,(2E)-;2-Pentenenitrile,3-methyl-5-phenyl-,(E)-;(2E)-3-Methyl-5-phenyl-2-pentenenitrile;trans-3-Methyl-5-phenyl-2-pentenenitrile
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CAS No:
Safety Information
P261, P264, P270, P272, P273, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P272, P273, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, and P501|Aggregated GHS information provided by 1202 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|P261, P264, P270, P271, P272, P273, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P321, P322, P330, P333+P313, P363, and P501|Aggregated GHS information provided by 321 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
(2E)-3-Methyl-5-phenyl-2-pentenenitrile Use and Manufacturing
2-Pentenenitrile, 3-methyl-5-phenyl-, (2E)-: ACTIVE
Computed Properties
Molecular Weight:171.24
XLogP3:3.3
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:171.104799419
Monoisotopic Mass:171.104799419
Topological Polar Surface Area:23.8
Heavy Atom Count:13
Complexity:213
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(2E)-3-Methyl-5-phenyl-2-pentenenitrile
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