| Phytochemical Name : Isopropyl acetate |
| PCNDIDI0106 |
| Pubchem CID : 7915 |
| Molecular formula: C5H10O2 |
| Canonical SMILES : CC(C)OC(=O)C |
Synonymes : ISOPROPYL ACETATE|108-21-4|2-Propyl acetate|2-Acetoxypropane|propan-2-yl acetate|Acetic acid, 1-methylethyl ester|Isopropyl ethanoate|Isopropylacetat|Paracetat|Isopropylacetaat|Acetic Acid, isopropyl ester|1-Methylethyl acetate|Acetate d'isopropyle|Acetic Acid Isopropyl Ester|Isopropylester kyseliny octove|Isopropile (acetato di)|Isopropyl (acetate d')|FEMA No. 2926|NSC 9295|Isopropile(acetato di)|CCRIS 6053|HSDB 159|Isopropylacetaat [Dutch]|Isopropylacetat [German]|Isopropyle (acetate d')|iso-propyl acetate|EINECS 203-561-1|sec-Propyl acetate|UNII-1Y67AFK870|Acetate d'isopropyle [French]|Isopropyl ester of acetic acid|BRN 1740761|IsopropylAcetate-d10|Acetic acid 1-methylethyl ester|DTXSID2025478|1Y67AFK870|Isopropyl (acetate d') [French]|Isopropyle (acetate d') [French]|Isopropile (acetato di) [Italian]|NSC-9295|UN1220|CH3COOCH(CH3)2|Isopropylester kyseliny octove [Czech]|Acetic acid, 2-propyl ester|DTXCID605478|EC 203-561-1|4-02-00-00141 (Beilstein Handbook Reference)|Isopropyl acetate [UN1220] [Flammable liquid]|ISOPROPYL ACETATE (USP-RS)|ISOPROPYL ACETATE [USP-RS]|CAS-108-21-4|1398065-53-6|ISOPROPYL ACETATE (1,1,1,3,3,3-D6)|2-propylacetate|Ispropyl acetate|iso-propylacetate|i-propyl acetate|AcOiPr|iPrOAc|iso-PrOAc|so-Propyl acetate|IPAc|i-PrOAc|Actate d'isopropyle|MFCD00008877|acetic acid isopropyl|propan-2-yl ethanoate|Isopropyl(acetate d')|Isopropylacetat(german)|IAC (CHRIS Code)|2-METHYLETHANOATE|Isopropyl acetate, 98%|Isopropyl acetate, 99%|Acetic acid-isopropyl ester|WLN: 1YOV1|1-Methylethyl acetate, 9CI|SCHEMBL19193|acetic acid propan-2-yl ester|ISOPROPYL ACETATE [MI]|Isopropyl Acetate Reagent Grade|ISOPROPYL ACETATE [FCC]|Isopropyl acetate, >=99.6%|CHEMBL1608674|ISOPROPYL ACETATE [FHFI]|ISOPROPYL ACETATE [HSDB]|ISOPROPYL ACETATE [INCI]|FEMA 2926|2-Propylacetat (Isopropylacetat)|Isopropylacetat (2-Propylacetat)|NSC9295|1-Methylethyl ester of acetic acid|Isopropyl acetate, >=99%, FCC|Isopropyl Acetate (Fragrance Grade)|Tox21_201443|Tox21_303287|LS-455|NA1220|Isopropyl acetate, analytical standard|AKOS008949447|AT32600|UN 1220|NCGC00091731-01|NCGC00091731-02|NCGC00257073-01|NCGC00258994-01|A0036|EN300-42702|A801824|Isopropyl acetate [UN1220] [Flammable liquid]|Q419799|Isopropyl acetate, puriss. p.a., >=99.5% (GC)|J-002073|Isopropyl acetate, anhydrous, ZerO2(TM), >=99.6%|Isopropyl acetate, United States Pharmacopeia (USP) Reference Standard |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 1.600 |
| Log Po/w (XLOGP3) : 0.920 |
| Log Po/w (WLOGP) : 0.960 |
| Log Po/w (MLOGP) : 0.890 |
| Log Po/w (SILICOS-IT) : 0.500 |
| Consensus Log Po/w : 0.980 |

