Cas no 74649-90-4 (1,4,7,10,13-Pentaoxacyclopentadecane,2,2-dimethyl-)
74649-90-4 structure
Product Name:1,4,7,10,13-Pentaoxacyclopentadecane,2,2-dimethyl-
CAS No:74649-90-4
MF:C12H24O5
MW:248.315964698792
CID:568677
PubChem ID:12597912
Update Time:2025-04-19
1,4,7,10,13-Pentaoxacyclopentadecane,2,2-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,4,7,10,13-Pentaoxacyclopentadecane,2,2-dimethyl-
- 2,2-Dimethyl-1,4,7,10,13-pentaoxacyclopentadecane
- 1,4,7,10,13-Pentaoxacyclopentadecane, 2,2-dimethyl-
- 2,2-Dimethyl-15-crown-5
- DTXSID30225623
- NS00037642
- 8CX3GB2U9G
- UNII-8CX3GB2U9G
- 74649-90-4
- EINECS 277-941-0
-
- Inchi: 1S/C12H24O5/c1-12(2)11-16-8-7-14-4-3-13-5-6-15-9-10-17-12/h3-11H2,1-2H3
- InChI Key: DFAFZVPNKONQTA-UHFFFAOYSA-N
- SMILES: O1CCOCCOCCOCCOCC1(C)C
Computed Properties
- Exact Mass: 248.16242
- Monoisotopic Mass: 248.16237386g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 0
- Complexity: 184
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: -0.1
- Topological Polar Surface Area: 46.2?2
Experimental Properties
- Density: 0.956
- Boiling Point: 346.8°C at 760 mmHg
- Flash Point: 138.9°C
- Refractive Index: 1.403
- PSA: 46.15
1,4,7,10,13-Pentaoxacyclopentadecane,2,2-dimethyl- Related Literature
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
-
Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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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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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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