| Phytochemical Name : Ethyl butyrate |
| PCNDIDE0086 |
| Pubchem CID : 7762 |
| Molecular formula: C6H12O2 |
| Canonical SMILES : CCCC(=O)OCC |
Synonymes : ETHYL BUTYRATE|Ethyl butanoate|105-54-4|Butyric acid ethyl ester|Ethyl n-butyrate|Butanoic acid, ethyl ester|Ethyl n-butanoate|Butyric ester|Butyric ether|Butanoic acid ethyl ester|Butyric acid, ethyl ester|FEMA No. 2427|FEMA Number 2427|Ethyl 1-butyrate|Ethyl butyrate (natural)|n-Butyric acid ethyl ester|NSC 8857|CCRIS 6554|HSDB 406|UNII-UFD2LZ005D|EINECS 203-306-4|UFD2LZ005D|Ethyl ester of butanoic acid|BRN 0506331|DTXSID6040111|CHEBI:88764|AI3-18427|NSC-8857|UN1180|DTXCID4020111|4-02-00-00787 (Beilstein Handbook Reference)|ETHYL BUTYRATE-4,4,4-D3|MFCD00009394|Butanoate d'thyle|Butyric acid ethyl|Nat. Ethyl Butyrate|UN 1180|Ethyl Butyrate Natural|Ethyl butyrate, 99%|EBR (CHRIS Code)|Butyric acid-ethyl ester|SCHEMBL6115|ETHYL BUTYRATE [MI]|ETHYL BUTYRATE [FCC]|WLN: 3VO2|CHEMBL44800|ETHYL BUTYRATE [FHFI]|ETHYL N-BUTYRATE [HSDB]|FEMA 2427|NSC8857|Ethyl butyrate, analytical standard|Tox21_300065|LMFA07010874|NA1180|Ethyl butyrate, >=98%, FCC, FG|AKOS008948342|LS-2361|NCGC00247893-01|NCGC00253968-01|CAS-105-54-4|B0759|Ethyl butyrate, natural, >=98%, FCC, FG|FT-0623347|EN300-54773|Ethyl butyrate [UN1180] [Flammable liquid]|Ethyl butyrate [UN1180] [Flammable liquid]|Q412270|J-001444|F0001-0107 |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 1.900 |
| Log Po/w (XLOGP3) : 1.650 |
| Log Po/w (WLOGP) : 1.350 |
| Log Po/w (MLOGP) : 1.270 |
| Log Po/w (SILICOS-IT) : 1.080 |
| Consensus Log Po/w : 1.450 |

