| Phytochemical Name : Methyl propionate |
| PCNDIDM0113 |
| Pubchem CID : 11124 |
| Molecular formula: C4H8O2 |
| Canonical SMILES : CCC(=O)OC |
Synonymes : METHYL PROPIONATE|Methyl propanoate|554-12-1|Propanoic acid, methyl ester|Methyl propylate|Methylpropionate|Propionic acid, methyl ester|Propionate de methyle|PROPIONIC ACID METHYL ESTER|FEMA No. 2742|FEMA Number 2742|Propanoic acid methyl ester|Methyl Propionate (natural)|NSC 9375|HSDB 5688|formyl propionate|EINECS 209-060-4|UNII-NB21C0D33W|Methylester kyseliny propionove|BRN 1737628|NB21C0D33W|Propionate de methyle [French]|AI3-10621|NSC-9375|UN1248|Methylester kyseliny propionove [Czech]|Methyl ester of propanoic acid|DTXSID7027201|CHEBI:89873|4-02-00-00704 (Beilstein Handbook Reference)|WE(1:0/3:0)|methyl proprionate|MFCD00009306|propionic acid methyl|Methyl propionate, 99%|C2H5COOCH3|Propionic acid-methyl ester|WLN: 2VO1|METHYL PROPANOATE [MI]|DTXCID507201|CHEMBL3183973|METHYL PROPIONATE [FHFI]|METHYL PROPIONATE [HSDB]|FEMA 2742|NSC9375|Methyl propionate, >=98%, FG|AMY21940|Tox21_200730|LMFA07010410|NA1248|Methyl propionate, analytical standard|AKOS008908807|LS-2956|UN 1248|NCGC00248813-01|NCGC00258284-01|CAS-554-12-1|FT-0628797|Methyl propionate, purum, >=99.0% (GC)|P0508|S0301|EN300-70278|Methyl propionate [UN1248] [Flammable liquid]|A830633|Methyl propionate [UN1248] [Flammable liquid]|Q418391|B64DF78F-37BE-4C30-A4DB-6EB6AD7FDD52|J-522628 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.680 |
| Log Po/w (XLOGP3) : 0.840 |
| Log Po/w (WLOGP) : 0.570 |
| Log Po/w (MLOGP) : 0.490 |
| Log Po/w (SILICOS-IT) : 0.280 |
| Consensus Log Po/w : 0.770 |