5-nitrooctan-2-one
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5-nitrooctan-2-one
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CAS No:
7404-84-4
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Formula:
C8H15NO3
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Chemical Name:
5-nitrooctan-2-one
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Synonyms:
5-nitro-octan-2-one;
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CAS No:
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:173.21
XLogP3:1.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:173.10519334
Monoisotopic Mass:173.10519334
Topological Polar Surface Area:62.9
Heavy Atom Count:12
Complexity:162
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 5-nitrooctan-2-one
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