4-phenylhexan-3-one
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4-phenylhexan-3-one
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CAS No:
6957-17-1
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Formula:
C12H16O
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Chemical Name:
4-phenylhexan-3-one
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Synonyms:
4-phenylhexan-3-one;4-Phenyl-3-hexanone;6957-17-1;NSC66178;SCHEMBL12513638;DTXSID60290026;NSC-66178;AKOS006346531;MCULE-1974332634
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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:176.25
XLogP3:2.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:176.120115130
Monoisotopic Mass:176.120115130
Topological Polar Surface Area:17.1
Heavy Atom Count:13
Complexity:157
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4-phenylhexan-3-one
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