Cas no 109350-13-2 (Decanoic acid, 2,3-bis(acetyloxy)propyl ester, (+-)-)
109350-13-2 structure
Product Name:Decanoic acid, 2,3-bis(acetyloxy)propyl ester, (+-)-
CAS No:109350-13-2
MF:C17H30O6
MW:330.416506290436
CID:153329
Update Time:2024-01-25
Decanoic acid, 2,3-bis(acetyloxy)propyl ester, (+-)- Chemical and Physical Properties
Names and Identifiers
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- Decanoic acid, 2,3-bis(acetyloxy)propyl ester, (+-)-
- 1,2-Diacetyl-3-decanoylglycerol
- 2,3-diacetyloxypropyl decanoate
- Dic2OCOC9
- Decanoic acid, 2,3-bis(acetyloxy)propyl ester
-
- Inchi： 1S/C17H30O6/c1-4-5-6-7-8-9-10-11-17(20)22-13-16(23-15(3)19)12-21-14(2)18/h16H,4-13H2,1-3H3
- InChI Key： IFKLBBIPFXRVBR-UHFFFAOYSA-N
- SMILES： C(OCC(OC(C)=O)COC(C)=O)(=O)CCCCCCCCC
Computed Properties
- Exact Mass: 330.2043
- Monoisotopic Mass: 330.204
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 23
- Rotatable Bond Count: 16
- Complexity: 353
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.3
Experimental Properties
- Density: 1.032
- Boiling Point: 372°C at 760 mmHg
- Flash Point: 156.8°C
- Refractive Index: 1.45
- PSA: 78.9
Decanoic acid, 2,3-bis(acetyloxy)propyl ester, (+-)- Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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