WHC is still in active development. Read this to understand our approach.
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isomerdesign

BMK

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pubchem

Phenylacetone

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wiki

Phenylacetone

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Data

InChI: InChI=1S/C9H10O/c1-8(10)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3

Synonyms: 103-79-7,1-Phenylacetone,Phenylacetone, analytical standard,methylbenzyl ketone,BDBM50167968,ghl.PD_Mitscher_leg0.660,Benzylmethylketone,STL373560,BCP22277,3-Phenyl-2-propanone,SCHEMBL43943,Phenylacetone, 99%,NSC 9827,136675-26-8,1-Phenyl-2-propanone,PHENYLACETONE [MI],phenyl 2-propanone,ZINC1700205,CHEMBL3800510,DEXTROAMPHETAMINE RELATED COMPOUND B CII,SCHEMBL13341529,DEA No. 8501,HSDB 8385,BMK,AMFETAMINE SULFATE IMPURITY B [EP IMPURITY],2-Propanone, 1-phenyl-,DEXTROAMPHETAMINE RELATED COMPOUND B [USP-RS],Methyl benzyl ketone,Phenyl-2-propanone,A800807,CHEBI:52052,NSC-9827,UNII-O7IZH10V9Y,Q418831,DEXTROAMPHETAMINE RELATED COMPOUND B [USP IMPURITY],Dextroamphetamine Related Compound B, United States Pharmacopeia (USP) Reference Standard,1-Phenylpropan-2-one,Phenylacetone,Phenylmethyl methyl ketone,DTXSID1059280,Benzyl methyl ketone,O7IZH10V9Y,EINECS 203-144-4,P2P,1-Phenylpropane-2-one,DEXTROAMPHETAMINE RELATED COMPOUND B,NSC9827,AI3-02938,phenyl acetone,(phenyl)acetone,FT-0673719,AKOS004905656,1-phenylpropan-2-one,1-phenyl-propan-2-one

Estimated data

Solubility: -1.4 (log(S) in mol/L prediction using SolTranNet)

Blood Brain Barrier Permeability: Yes (prediction using frontiersin.org)

Addictivity Prediction: 68.6% (prediction based on www.mdpi.com)

Similarities

The following is a set of comparisons to understand the properties of this compound. This is still higly experimental and is still under active development. Please refer to our series of blog posts to fully understand our approach and its limitations. This information is for informational purposes only and should not be construed as medical advice.