Citation: YE Bin, GAO Cai, ZHAO Han, CHEN Kai-Song, YANG Suo, LIU Xiang-Nong. ¹H NMR Investigation on Effect of Solute Concentration on the Hydrogen Bonding and Glass Transition of Three-Carbon Polyalcohol Aqueous Solutions[J]. Acta Physico-Chimica Sinica, ;2011, 27(11): 2505-2511. doi: 10.3866/PKU.WHXB20111103 shu

¹H NMR Investigation on Effect of Solute Concentration on the Hydrogen Bonding and Glass Transition of Three-Carbon Polyalcohol Aqueous Solutions

1.
School of Mechanical and Automotive Engineering, Hefei University of Technology, Hefei 230009, P. R. China

Received Date: 2 June 2011
Available Online: 29 August 2011
Fund Project: 国家自然科学基金(20803016) (20803016)安徽省自然科学基金(070414163)资助项目 (070414163)

We investigated the effects of solute concentration on the hydrogen bonding interactions of three-carbon polyalcohol aqueous solutions. In order to inspect the capacity of the solutions to form glass, proton nuclear magnetic resonance (¹H NMR) chemical shifts were determined in binary mixtures of water and 1-propanol (NPA), 2-propanol (IPA), 1,2-propanediol (PG), 1,3-propanediol (PD), and glycerol at room temperature and at atmospheric pressure using the external reference method. We found that the alkyl proton chemical shifts of PG with the CH₃CH(OH)― group showed biphasic behavior, which was different from other molecules. Water molecules formed relatively strong O ― H···O hydrogen bonds with the alcohol hydroxyls. The proton chemical shifts of H₂O and the hydroxyl protons decrease with an increase in the number of alcohol hydroxyls at the same mole fraction. Moreover, the proton chemical shifts of H₂O and hydroxyl protons with the same number of alcohol hydroxyls are different because of their different locations. The order of increased basicity agrees with the order of increased ice homogeneous nucleation suppression, that is, glycerol>PG>PD>IPA>NPA. This explains why glycerol and PG are more suitable as cryoprotective agents (CPAs) among the five polyalcohols.
- ¹H nuclear magnetic resonance,
- Three-carbon polyalcohol,
- Aqueous solution,
- Cryoprotective agent,
- Proton chemical shift,
- Hydrogen bonding
1. [1]
  (1) Hua, Z. C.; Ren, H. S. Cryobiomedical Techniques; Science Press: Beijing, 1994; p 12. [华泽钊, 任禾盛. 北京: 低温生物医学技术. 科学出版社, 1994, p 12]
2. [2]
  (2) Hua, Z. C.; Liu B. L.; Zuo J. G. Freeze-Drying of Pharmaceutical and Food Products; Science Press: Beijing, 2006; p 123. [华泽钊, 刘宝林, 左建国. 药品和食品的冷冻干燥. 北京: 科学出版社, 2006; p 123.]
3. [3]
  (3) Gao, C.;Wang, T. J.; Liu, X. N.; Zhou, G. Y.; Hua, T. C. Chin. J. Chem. Phys. 2007, 20, 258.
4. [4]
  (4) Gao, C.; Zhou, G. Y.; Xu, Y.; Hua, T. C. Thermochim. Acta 2005, 435, 38.
5. [5]
  (5) Gao, C.;Wang, T. J.; Liu, X. N.; Zhou, G. Y.; Hua, T. C. Thermochim. Acta 2007, 456, 19.
6. [6]
  (6) Gao, C.;Wang, T. J.; Zhou, G. Y.; Hua. Z. Z. Chem. J. Chin. Univ. 2007, 28, 1139. [高才, 王铁军, 周国燕, 华泽钊. 高等学校化学学报, 2007, 28, 1139.]
7. [7]
  (7) Hisashi, H.; Keiko, N.; Takao, I. J. Phys. Chem. 1990, 94, 8334.
8. [8]
  (8) Zelent, B.; Nucci, N. V.; Vanderkooi, J. M. J. Phys. Chem. A 2004, 108, 11141.
9. [9]
  (9) Oakes, J. J. Chem. Soc., Faraday Trans. 2. 1972, 68, 1464.
10. [10]
  (10) Wen,W. Y.; Hertz, H. G. J. Solution Chem. 1972, 1, 17.
11. [11]
  (11) Sare, E. J.; Moynihan, C. T.; Angell, C. A. J. Phys. Chem. 1973, 77, 1869.
12. [12]
  (12) Hinton, J. F.; Ladner, K. H. Spectrochimica Acta Part A-Molecular Spectroscopy 1972, 28, 1731.
13. [13]
  (13) Holmes, J. R.; Kivelson, D.; Drinkard,W. C. J. Am. Chem. Soc. 1962, 84, 4677.
14. [14]
  (14) Bhanumathi, R.; Vijayalakshamme, S. K. J. Phys. Chem. 1986, 90, 4666.
15. [15]
  (15) Fratiello, A.; Luon , J. P. J. Am. Chem. Soc. 1963, 85, 3072.
16. [16]
  (16) Barone, G.; Castronuovo, G.; Della, V. C.; Elia, V. J. Solution Chem. 1977, 6, 117.
17. [17]
  (17) Anderson, R. G.; Symons, M. C. Trans. Faraday Soc. 1969, 65, 2550.
18. [18]
  (18) Fratiello, A.; Douglass, D. C. J. Mol. Spectrosc. 1963, 11, 465.
19. [19]
  (19) Klein, R.A.; Pacheco, V. J. Phys. Chem. A 2001, 105, 9298.
20. [20]
  (20) Forsyth, M.; MacFarlane, D.R. J. Phys. Chem. 1990, 94, 6889.
21. [21]
  (21) Zhou, Y.; Hu, K.; Shen, J. F.;Wu, X. J.; Cheng, G. Z. J. Mol. Struct. 2009, 921, 150.
22. [22]
  (22) Hills, B.P.; Pardoe, K. J. Mol. Liq. 1995, 63, 229.
23. [23]
  (23) Bhanumathi, R.; Vijayalakshamma, S. K. J. Phys. Chem. 1986, 90, 4666.
24. [24]
  (24) Mizuno, K.; Miyashita, Y.; Shindo, Y.; Ogawa, H. J. Phys. Chem. 1995, 99, 3225.
25. [25]
  (25) Xiang, S.J.; Yu, G.Q.; Liang, Y. M.;Wu, L. M. J. Mol. Struct. 2006, 789, 43.
26. [26]
  (26) Yadav, M. K.; Kumar, A. J. Molecular Liquids 2005, 121, 94.
27. [27]
  (27) Mizuno, K.; Kimura, Y.; Morichika, H.; Nishimura, Y.; Shimada, S.; Maeda, S.; Imafuji, S.; Ochi, T. J. Mol. Liq. 2000, 85, 139.
28. [28]
  (28) Selwood, P.W. Magnetochemistry; Interscience: New York, 1943.
29. [29]
  (29) The Handbook of Chemistry and Physics; CRC: Cleveland, OH, 1974.
30. [30]
  (30) Pople, J. A.; Schneider,W. G.; Barnstein, H. J. High Resolution NMR, McGraw-Hill: New York, 1967.
31. [31]
  (31) Becker, E. D. High Resolution NMR ; Theory and Chemical Applications, 2nd ed.; Academic Press: New York, 1980.
32. [32]
  (32) Larman, M. G.; Katz-Jaffe, M. G.; Sheehan, C. B.; Gardner, D. K. Hum. Reprod. 2007, 22, 250.
33. [33]
  (33) Wowk, B.; Darwin, M.; Harris, S. B.; Russell, S. R.; Rasch, C. M. J. Cryobiology 1999, 39, 215.
34. [34]
  (34) Deshmukh, M. M.; Sastry, N. V.; Gadre, S. R. J. Chem. Phys. 2004, 121, 12402.
35. [35]
  (35) Ziedler, M.D. In Water: A Comprehensive Treatise; Franks, F. Ed.; Plenum: New York, 1973, Vol. 2. (36) Streitweiser, A.; Heathcock, C.H. Introduction to Organic Chemistry, 2nd ed.; MacMillan: New York, 1981.
36. [36]
  (37) MarFarlane, D. R.; Forsyth, M. J. Cryobiology 1990, 27, 345.
37. [37]
  (38) Emiliani, S.; Bergh, M. V.; den Vannin, A. S.; Biramane, J.; Englert, Y. Hum. Reprod. 2000, 15, 905.
38. [38]
  (39) Gao, C. Thermal Phenomena Study of Linear Polyalcohols aqueous solutions at low Temperature. Ph. D. Dissertation, University of ShangHai for Science and Technology, Shanghai, 2004. [高才. 线性多元醇水溶液低温下的热现象研究[D]. 上海:上海理工大学, 2004.]
1. [1]
  Bo YANG , Gongxuan LÜ , Jiantai MA . Corrosion inhibition of nickel-cobalt-phosphide in water by coating TiO₂ layer. Chinese Journal of Inorganic Chemistry, 2025, 41(2): 365-384. doi: 10.11862/CJIC.20240063
2. [2]
  Zhuoming Liang , Ming Chen , Zhiwen Zheng , Kai Chen . Multidimensional Studies on Ketone-Enol Tautomerism of 1,3-Diketones By ¹H NMR. University Chemistry, 2024, 39(7): 361-367. doi: 10.3866/PKU.DXHX202311029
3. [3]
  Huiying Xu , Minghui Liang , Zhi Zhou , Hui Gao , Wei Yi . Application of Quantum Chemistry Computation and Visual Analysis in Teaching of Weak Interactions. University Chemistry, 2025, 40(3): 199-205. doi: 10.12461/PKU.DXHX202407011
4. [4]
  Ling-Hao Zhao , Hai-Wei Yan , Jian-Shuang Jiang , Xu Zhang , Xiang Yuan , Ya-Nan Yang , Pei-Cheng Zhang . Effective assignment of positional isomers in dimeric shikonin and its analogs by ¹H NMR spectroscopy. Chinese Chemical Letters, 2024, 35(5): 108863-. doi: 10.1016/j.cclet.2023.108863
5. [5]
  Yinglian LI , Chengcheng ZHANG , Xinyu ZHANG , Xinyi WANG . Spin crossover in [Co(pytpy)₂]²⁺ complexes modified by organosulfonate anions. Chinese Journal of Inorganic Chemistry, 2024, 40(6): 1162-1172. doi: 10.11862/CJIC.20240087
6. [6]
  Runze Liu , Yankai Bian , Weili Dai . Qualitative and quantitative analysis of Brønsted and Lewis acid sites in zeolites: A combined probe-assisted 1H MAS NMR and NH3-TPD investigation. Chinese Journal of Structural Chemistry, 2024, 43(4): 100250-100250. doi: 10.1016/j.cjsc.2024.100250
7. [7]
  Jiying Liu , Zehua Li , Wenjing Zhang , Donghui Wei . Molecular Orbital and Nucleus-Independent Chemical Shift Calculations for C₆H₆ and B₁₂H₁₂^2-: A Computational Chemistry Experiment. University Chemistry, 2025, 40(3): 186-192. doi: 10.12461/PKU.DXHX202406085
8. [8]
  Jun LUO , Baoshu LIU , Yunchang ZHANG , Bingkai WANG , Beibei GUO , Lan SHE , Tianheng CHEN . Europium(Ⅲ) metal-organic framework as a fluorescent probe for selectively and sensitively sensing Pb²⁺ in aqueous solution. Chinese Journal of Inorganic Chemistry, 2024, 40(12): 2438-2444. doi: 10.11862/CJIC.20240240
9. [9]
  Yongzhi LI , Han ZHANG , Gangding WANG , Yanwei SUI , Lei HOU , Yaoyu WANG . A two-dimensional metal-organic framework for the determination of nitrofurantoin and nitrofurazone in aqueous solution. Chinese Journal of Inorganic Chemistry, 2025, 41(2): 245-253. doi: 10.11862/CJIC.20240307
10. [10]
  Wen-Tao Ouyang , Jun Jiang , Yan-Fang Jiang , Ting Li , Yuan-Yuan Liu , Hong-Tao Ji , Li-Juan Ou , Wei-Min He . Sono-photocatalytic amination of quinoxalin-2(1H)-ones with aliphatic amines. Chinese Chemical Letters, 2024, 35(10): 110038-. doi: 10.1016/j.cclet.2024.110038
11. [11]
  Xiao-Ming Chen , Lianhui Song , Jun Pan , Fei Zeng , Yi Xie , Wei Wei , Dong Yi . Visible-light-induced four-component difunctionalization of alkenes to construct phosphorodithioate-containing quinoxalin-2(1H)-ones. Chinese Chemical Letters, 2024, 35(11): 110112-. doi: 10.1016/j.cclet.2024.110112
12. [12]
  Jiahe LIU , Gan TANG , Kai CHEN , Mingda ZHANG . Effect of low-temperature electrolyte additives on low-temperature performance of lithium cobaltate batteries. Chinese Journal of Inorganic Chemistry, 2025, 41(4): 719-728. doi: 10.11862/CJIC.20250023
13. [13]
  Guangming YIN , Huaiyao WANG , Jianhua ZHENG , Xinyue DONG , Jian LI , Yi'nan SUN , Yiming GAO , Bingbing WANG . Preparation and photocatalytic degradation performance of Ag/protonated g-C₃N₄ nanorod materials. Chinese Journal of Inorganic Chemistry, 2024, 40(8): 1491-1500. doi: 10.11862/CJIC.20240086
14. [14]
  Xue Dong , Xiaofu Sun , Shuaiqiang Jia , Shitao Han , Dawei Zhou , Ting Yao , Min Wang , Minghui Fang , Haihong Wu , Buxing Han . 碳修饰的铜催化剂实现安培级电流电化学还原CO₂制C₂₊产物. Acta Physico-Chimica Sinica, 2025, 41(3): 2404012-. doi: 10.3866/PKU.WHXB202404012
15. [15]
  Liyang ZHANG , Dongdong YANG , Ning LI , Yuanyu YANG , Qi MA . Crystal structures, luminescent properties and Hirshfeld surface analyses of three cadmium(Ⅱ) complexes based on 2-(3-(pyridin-2-yl)-1H-pyrazol-1-yl)benzoate. Chinese Journal of Inorganic Chemistry, 2024, 40(10): 1943-1952. doi: 10.11862/CJIC.20240079
16. [16]
  Cheng Rong , Jiang Jiang , Xinyu Zheng . Constructivism and Deconstructivism in General Chemistry Teaching: Taking the Teaching of Colloidal Solutions as an Example. University Chemistry, 2024, 39(2): 292-297. doi: 10.3866/PKU.DXHX202308035
17. [17]
  Yinuo Wu , Jiantao Ye , Xie Zhou , Yu Qian , Lei Guo . Teaching Design of Basic Chemistry Based on PBL Methodology for Medical Undergraduates: A Case Study on “Osmotic Pressure of Solution”. University Chemistry, 2024, 39(3): 149-157. doi: 10.3866/PKU.DXHX202309077
18. [18]
  Xinxue Li . The Application of Reverse Thinking in Teaching of Boiling Point Elevation and Freezing Point Depression of Dilute Solutions in General Chemistry. University Chemistry, 2024, 39(11): 359-364. doi: 10.3866/PKU.DXHX202401075
19. [19]
  Jingzhao Cheng , Shiyu Gao , Bei Cheng , Kai Yang , Wang Wang , Shaowen Cao . 4-氨基-1H-咪唑-5-甲腈修饰供体-受体型氮化碳光催化剂的构建及其高效光催化产氢研究. Acta Physico-Chimica Sinica, 2024, 40(11): 2406026-. doi: 10.3866/PKU.WHXB202406026
20. [20]
  Xu Liu , Chengfang Liu , Jie Huang , Xiangchun Li , Wenyong Lai . Research on the Application of Diversified Teaching Models in the Teaching of Physical Chemistry. University Chemistry, 2024, 39(8): 112-118. doi: 10.3866/PKU.DXHX202402021

Get Citation

PDF

XML

Metrics

PDF Downloads(905)
Abstract views(2712)
HTML views(45)

通讯作者: 陈斌, bchen63@163.com

1.
沈阳化工大学材料科学与工程学院沈阳 110142

1H NMR Investigation on Effect of Solute Concentration on the Hydrogen Bonding and Glass Transition of Three-Carbon Polyalcohol Aqueous Solutions

Metrics

通讯作者: 陈斌, bchen63@163.com

¹H NMR Investigation on Effect of Solute Concentration on the Hydrogen Bonding and Glass Transition of Three-Carbon Polyalcohol Aqueous Solutions