Cas no 52670-94-7 ((+-)-4-Megastigmen-3,9-dion)
(+-)-4-Megastigmen-3,9-dion structure
Product Name:(+-)-4-Megastigmen-3,9-dion
CAS No:52670-94-7
MF:C13H20O2
MW:208.296704292297
CID:2035205
Update Time:2025-03-25
(+-)-4-Megastigmen-3,9-dion Chemical and Physical Properties
Names and Identifiers
-
- (+-)-4-Megastigmen-3,9-dion
- (6R)-4-megastigmen-3,9-dione
- 3-oxodihydro-alpha-ionone
- 4-(2,6,6-Trimethyl-4-oxocyclohex-2-enyl)butan-2-one
- 4-Megastigmen-3,9-dion
- 4-megastigmen-3,9-dione
- 4-megastigmene-3,9-dione
- (-)-7,8-Dihydro-alpha-ionone
- 2-Cyclohexen-1-one, 3,5,5-trimethyl-4-(3-oxobutyl)-, (4R)-
-
- Inchi： 1S/C13H20O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h7,12H,5-6,8H2,1-4H3
- InChI Key： GSTVTHMQXVKNQF-UHFFFAOYSA-N
- SMILES： CC(CCC1C(C)(C)CC(=O)C=C1C)=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- XLogP3: 2.015
Experimental Properties
- Density: 0.945±0.06 g/cm3(Predicted)
- Boiling Point: 307.3±21.0 °C(Predicted)
(+-)-4-Megastigmen-3,9-dion Related Literature
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1. 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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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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