Cas no 16902-40-2 (Titanium,diethoxybis(2,4-pentanedionato-kO2,kO4)-)
16902-40-2 structure
Product Name:Titanium,diethoxybis(2,4-pentanedionato-kO2,kO4)-
CAS No:16902-40-2
MF:C14H24O6Ti
MW:336.203765869141
CID:160406
Update Time:2024-01-25
Titanium,diethoxybis(2,4-pentanedionato-kO2,kO4)- Chemical and Physical Properties
Names and Identifiers
-
- Titanium,diethoxybis(2,4-pentanedionato-kO2,kO4)-
- ethanolate,(Z)-4-oxopent-2-en-2-olate,titanium(4+)
- Diethoxybis(pentane-2,4-dionato-O,O')titanium
- titanium(4+) diethanolate bis[(2Z)-4-oxopent-2-en-2-olate]
- Einecs 240-946-3
-
- Inchi： 1S/2C5H8O2.2C2H5O.Ti/c2*1-4(6)3-5(2)7;2*1-2-3;/h2*3,6H,1-2H3;2*2H2,1H3;/q;;2*-1;+4/p-2/b2*4-3-;;;
- InChI Key： NQRMJWMYVKGTFM-VGKOASNMSA-L
- SMILES： C([O-])C.C/C(/[O-])=C/C(=O)C.C([O-])C.C/C(/[O-])=C/C(=O)C.[Ti+4]
Computed Properties
- Exact Mass: 336.105236
- Monoisotopic Mass: 336.105236
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 21
- Rotatable Bond Count: 2
- Complexity: 93.1
- Covalently-Bonded Unit Count: 5
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 126
Experimental Properties
- Boiling Point: 187.6°C at 760 mmHg
- Flash Point: 71.9°C
Titanium,diethoxybis(2,4-pentanedionato-kO2,kO4)- Related Literature
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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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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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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