| Phytochemical Name : 2-Pentanone |
| PCNDIDOT0658 |
| Pubchem CID : 7895 |
| Molecular formula: C5H10O |
| Canonical SMILES : CCCC(=O)C |
Synonymes : 2-Pentanone|PENTAN-2-ONE|107-87-9|METHYL PROPYL KETONE|Ethyl acetone|Pentanone|Ethylacetone|Methyl n-propyl ketone|Propyl methyl ketone|Metylopropyloketon|Methylpropyl ketone|Methyl-propyl-cetone|FEMA No. 2842|2-Pentanone (natural)|FEMA Number 2842|pentanone-2|Metylopropyloketon [Polish]|NSC 5350|Methyl-propyl-cetone [French]|HSDB 158|4-methyl-2-butanone|n-propyl methyl ketone|Methyl-n-propyl ketone|EINECS 203-528-1|UN1249|n-C3H7COCH3|BRN 0506058|AI3-32118|DTXSID0021888|UNII-I97392I10V|CHEBI:16472|NSC-5350|I97392I10V|EC 203-528-1|4-01-00-03271 (Beilstein Handbook Reference)|Methyl propyl ketone [UN1249] [Flammable liquid]|MPK|DTXCID301888|Pentan-2-on|CAS-107-87-9|Metilpropilcetona|2-pentanona|2-pentanal|Mthyl propyl ctone|Pentanone, 2-|pentan - 2 - one|2-Pentanone, 90%|3bh3|MKE (CHRIS Code)|PNE (CHRIS Code)|Methyl Propyl Ketone FCC|2-PENTANONE [FCC]|2-PENTANONE [FHFI]|CHEMBL45345|2-Pentanon (Metylpropylketon)|WLN: 3V1|2-Pentanone, analytical standard|FEMA 2842|NSC5350|METHYL PROPYL KETONE [MI]|AMY25524|Methyl propyl ketone (2-pentanone)|METHYL PROPYL KETONE [HSDB]|2-Pentanone (Methyl propyl ketone)|2-Pentanone, for HPLC, 99.5%|Tox21_201670|Tox21_303016|LMFA12000003|LS-442|MFCD00009400|NA1249|2-Pentanone, >=98%, FCC, FG|2-Pentanone, reagent grade, >=90%|AKOS000121554|Methyl propyl ketone; see 2-Pentanone|UN 1249|2-Pentanone, >=99.0%, natural, FG|NCGC00249095-01|NCGC00256617-01|NCGC00259219-01|2-Pentanone, ultrapure grade, >=99.5%|FT-0613263|P0060|EN300-21239|C01949|A801775|Q209460|Methyl propyl ketone [UN1249] [Flammable liquid]|F0001-0145|2-Pentanone, ReagentPlus(R), >=99%, purified by redistillation |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 1.610 |
| Log Po/w (XLOGP3) : 0.910 |
| Log Po/w (WLOGP) : 1.380 |
| Log Po/w (MLOGP) : 1.010 |
| Log Po/w (SILICOS-IT) : 1.010 |
| Consensus Log Po/w : 1.180 |

