Cyclohepta-2,4,6-trienecarbonitrile
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Cyclohepta-2,4,6-trienecarbonitrile
structure -
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CAS No:
13612-59-4
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Formula:
C8H7N
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Chemical Name:
Cyclohepta-2,4,6-trienecarbonitrile
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Synonyms:
cyclohepta-2,4,6-triene-1-carbonitrile; 2,4,6-Cycloheptatriene-1-carbonitrile;
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CAS No:
Cyclohepta-2,4,6-trienecarbonitrile Basic Attributes
117.14800
117.057849228 g/mol
DTXSID70159670
2926909090
Safety Information
R20/21/22
S36
Xn
|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 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:117.15
XLogP3:2.1
Hydrogen Bond Acceptor Count:1
Exact Mass:117.057849228
Monoisotopic Mass:117.057849228
Topological Polar Surface Area:23.8
Heavy Atom Count:9
Complexity:196
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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