Cas no 7070-24-8 (1-HYDROXY-4-KETO-2-IONONE)
1-HYDROXY-4-KETO-2-IONONE structure
Product Name:1-HYDROXY-4-KETO-2-IONONE
CAS No:7070-24-8
MF:C13H18O3
MW:222.280224323273
CID:975516
Update Time:2024-03-05
1-HYDROXY-4-KETO-2-IONONE Chemical and Physical Properties
Names and Identifiers
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- 1-HYDROXY-4-KETO-2-IONONE
- 2-Cyclohexen-1-one-4-ol, 3,5,5-trimethyl-4-(3-oxo-1-butenyl)
- 4-Hydroxy-3,5,5-trimethyl-4-[3-oxo-1-butenyl]-2-cyclohexen-1-one
- 4-Hydroxy-4-(3-oxo-1-butenyl)-3,5,5-trimethylcyclohex-2-en-1-one
- 2-Cyclohexen-1-one, 4-hydroxy-3,5,5-trimethyl-4-(3-oxo-1-butenyl)-
- 4-Hydroxy-3,5,5-trimethyl-4-[(1E)-3-oxo-1-butenyl]-2-cyclohexen-1-one
- 2-Cyclohexen-1-one, 4-hydroxy-3,5,5-trimethyl-4-(3-oxo-1-buten-1-yl)-
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- Inchi： 1S/C13H18O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,16H,8H2,1-4H3
- InChI Key： JJRYPZMXNLLZFH-UHFFFAOYSA-N
- SMILES： C1(=O)CC(C)(C)C(O)(C=CC(=O)C)C(C)=C1
Computed Properties
- Exact Mass: 222.12564
Experimental Properties
- Density: 1.125±0.06 g/cm3(Predicted)
- Melting Point: 112-113 °C
- Boiling Point: 367.4±42.0 °C(Predicted)
- PSA: 54.37
- pka: 12.20±0.60(Predicted)
1-HYDROXY-4-KETO-2-IONONE Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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