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Quoted phrases not found in phrase index: "2,2-dimethylbutane", "b,b-dimethylbutane", "ethyltrimethylmethane", "trimethylethylmethane"
Page 1
2,2-Dimethylbutane (neohexane). CAS 75-83-2.
Galvin JB, Panson R. Galvin JB, et al. J Toxicol Environ Health A. 1999 Sep 10-24;58(1-2):103-10. doi: 10.1080/009841099157467. J Toxicol Environ Health A. 1999. PMID: 10537376 Review. No abstract available.
Computational Analysis of Vibrational Spectra of Hydrogen Bonds in sII and sH Gas Hydrates.
Guo Q, Wang HC, Liu XY, Yuan XQ, Dong XT, Li YN, Yin Y, Zhang P. Guo Q, et al. ACS Omega. 2023 Mar 13;8(12):11634-11639. doi: 10.1021/acsomega.3c01237. eCollection 2023 Mar 28. ACS Omega. 2023. PMID: 37008132 Free PMC article.
Two models of 576-atom propane-methane sII hydrate and 294-atom neohexane-methane sH hydrate were built. A first-principles density functional theory (DFT) method was employed using the CASTEP package. ...
Two models of 576-atom propane-methane sII hydrate and 294-atom neohexane-methane sH hydrate were built. A first-principles density f …
Direct space methods for powder X-ray diffraction for guest-host materials: applications to cage occupancies and guest distributions in clathrate hydrates.
Takeya S, Udachin KA, Moudrakovski IL, Susilo R, Ripmeester JA. Takeya S, et al. J Am Chem Soc. 2010 Jan 20;132(2):524-31. doi: 10.1021/ja905426e. J Am Chem Soc. 2010. PMID: 20000734
This method is also used to determine the guest disorder and cage occupancies of neohexane and tert-butyl methyl ether binary hydrates with CH(4) in the structure H clathrate hydrates. ...
This method is also used to determine the guest disorder and cage occupancies of neohexane and tert-butyl methyl ether binary hydrate …
Benchmark thermochemistry of the C(n)H(2n+2) alkane isomers (n = 2-8) and performance of DFT and composite ab initio methods for dispersion-driven isomeric equilibria.
Karton A, Gruzman D, Martin JM. Karton A, et al. J Phys Chem A. 2009 Jul 23;113(29):8434-47. doi: 10.1021/jp904369h. J Phys Chem A. 2009. PMID: 19569667
Our best atomization energies at 0 K (in kcal/mol) are 1220.04 for n-butane, 1497.01 for n-pentane, 1774.15 for n-hexane, 2051.17 for n-heptane, 2328.30 for n-octane, 1221.73 for isobutane, 1498.27 for isopentane, 1501.01 for neopentane, 1775.22 for isohexane, 1774.61 for 3-methy …
Our best atomization energies at 0 K (in kcal/mol) are 1220.04 for n-butane, 1497.01 for n-pentane, 1774.15 for n-hexane, 2051.17 for n-hept …
[Diurnal rhythm of Viburnum awabuki and Betula luminifera volatiles and electroantennogram response of Batocera horsfieldi].
Yang H, Yang W, Yang MF, Yang CP, Yang LG, Xutang XK. Yang H, et al. Ying Yong Sheng Tai Xue Bao. 2011 Feb;22(2):357-63. Ying Yong Sheng Tai Xue Bao. 2011. PMID: 21608247 Chinese.
After the feeding by B. horsfieldi, there was a decrease in the contents of limonene, nonanal, hexadecane, butyl acrylate, and 3-methyl-butanoic acid in damaged branches of V. awabuki and in the neohexane and hexadecane contents in damaged branches of B. luminifera. Simult …
After the feeding by B. horsfieldi, there was a decrease in the contents of limonene, nonanal, hexadecane, butyl acrylate, and 3-methyl-buta …
Inhibition of natural gas hydrates in the presence of liquid hydrocarbons forming structure H.
Seo Y, Kang SP, Jang W, Kim S. Seo Y, et al. J Phys Chem B. 2010 May 13;114(18):6084-8. doi: 10.1021/jp910941d. J Phys Chem B. 2010. PMID: 20397674
The effects of LMGS (large molecule guest substance) amount on the thermodynamics of natural gas hydrates, as well as structural characteristics of mixed hydrates of LMGS and natural gas, have been studied. The addition of 1.7 wt % neohexane (NH) to water induced inhibitio …
The effects of LMGS (large molecule guest substance) amount on the thermodynamics of natural gas hydrates, as well as structural characteris …
Phase equilibrium measurements and crystallographic analyses on structure-H type gas hydrate formed from the CH4-CO2-neohexane-water system.
Uchida T, Ohmura R, Ikeda IY, Nagao J, Takeya S, Hori A. Uchida T, et al. J Phys Chem B. 2006 Mar 16;110(10):4583-8. doi: 10.1021/jp056503e. J Phys Chem B. 2006. PMID: 16526688
Phase equilibrium conditions and the crystallographic properties of structure-H type gas hydrates containing various amounts of methane (CH4), carbon dioxide (CO2), neohexane (2,2-dimethylbutane; NH), and liquid water were investigated. When the CH4 concentration was as hi …
Phase equilibrium conditions and the crystallographic properties of structure-H type gas hydrates containing various amounts of methane (CH4 …
Enhanced CH₄ Recovery Induced via Structural Transformation in the CH₄/CO₂ Replacement That Occurs in sH Hydrates.
Lee Y, Kim Y, Seo Y. Lee Y, et al. Environ Sci Technol. 2015 Jul 21;49(14):8899-906. doi: 10.1021/acs.est.5b01640. Epub 2015 Jul 2. Environ Sci Technol. 2015. PMID: 26107753
The CH4/CO2 replacement that occurs in sH hydrates is investigated, with a primary focus on the enhanced CH4 recovery induced via structural transformation with a CO2 injection. In this study, neohexane (NH) is used as a liquid hydrocarbon guest in the sH hydrates. Direct …
The CH4/CO2 replacement that occurs in sH hydrates is investigated, with a primary focus on the enhanced CH4 recovery induced via structural …
Guest-host hydrogen bonding in structure H clathrate hydrates.
Susilo R, Alavi S, Moudrakovski IL, Englezos P, Ripmeester JA. Susilo R, et al. Chemphyschem. 2009 Mar 23;10(5):824-9. doi: 10.1002/cphc.200900024. Chemphyschem. 2009. PMID: 19222042
We contrast the structure and guest dynamics of the tert-butylmethylether (TBME) and neohexane (NH) sH clathrates by performing molecular dynamics simulations on these two clathrates and measuring (1)H and (13)C NMR relaxation times of the guests. ...
We contrast the structure and guest dynamics of the tert-butylmethylether (TBME) and neohexane (NH) sH clathrates by performing molec …