3-Nitrovalerophenone
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3-Nitrovalerophenone
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CAS No:
80460-02-2
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Formula:
C11H13NO3
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Chemical Name:
3-Nitrovalerophenone
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Synonyms:
3-Nitrovalerophenone;3-Nitro-1-phenylpentan-1-one;3-Nitro-1-phenyl-1-pentanone;beta-Nitrovalerophenone;SCHEMBL10956733;1-Pentanone,4-nitro-1-phenyl-;3-nitro-1-phenyl-pentan-1-one;CTK5E7807;DTXSID90341090;3-Nitro-1-phenyl-1-pentanone #
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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:207.23
XLogP3:2.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:207.08954328
Monoisotopic Mass:207.08954328
Topological Polar Surface Area:62.9
Heavy Atom Count:15
Complexity:229
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes