2,8,9-Trioxa-5-aza-1-borabicyclo[3.3.3]undecane

• Formula: C₆H₁₂BNO₃
• Molecular weight: 156.975
• IUPAC Standard InChI: InChI=1S/C6H12BNO3/c1-4-9-7-10-5-2-8(1)3-6-11-7/h1-6H2 Copy

  
• IUPAC Standard InChIKey: NKPKVNRBHXOADG-UHFFFAOYSA-N Copy
• CAS Registry Number: 283-56-7
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Other names: Boratran; Boratrane; Boric acid, tris(2-aminoethyl) ester; Boron, ((2,2',2''-nitrilotris(ethanolato))(3-))-; Ethanol, 2,2',2''-nitrilotri-, cyclic ester with boric acid (H3BO3) (1:1); Ethanol, 2,2',2''-nitrilotris-, cyclic ester with boric acid (H3BO3) (1:1); Triethanolamine borate; Atracor T; Ethanol, 2,2',2''-nitrilotri-, cyclic borate; NSC 5220
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• Information on this page:
  • Condensed phase thermochemistry data
  • Gas phase ion energetics data
  • References
  • Notes
• Other data available:
  • Phase change data
  • Mass spectrum (electron ionization)
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Condensed phase thermochemistry data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Eugene S. Domalski and Elizabeth D. Hearing

Constant pressure heat capacity of solid

Gas phase ion energetics data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

Ionization energy determinations

References

Go To: Top, Condensed phase thermochemistry data, Gas phase ion energetics data, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Castle, Stoesser, et al., 1964
Castle, P.; Stoesser, R.; Westrum, E.F., Jr., Triethanolamine borate. The heat capacity and thermodynamic functions from 5 to 350 K, J. Phys. Chem., 1964, 68, 49-51. [all data]

Clever, Wong, et al., 1964
Clever, H.L.; Wong, W.-K.; Wulff, C.A.; Westrum, E.F., Jr., Heat capacities and thermodynamic properties of globular molecules. III. Transition and fusion of triethanolamine borate, J. Phys. Chem., 1964, 68, 1967-1969. [all data]

Cradock, Ebsworth, et al., 1975
Cradock, S.; Ebsworth, E.A.V.; Muiry, I.B., Photoelectron spectra and bonding of (N-B) -2,8,9-trioxa-5-aza-1-bora-bicyclo[3.3.3]undecane (boratran) and some 2,8,9-trioxa-5-aza-1-sila- bicyclo[3.3.3]undecanes (silatrans), J. Chem. Soc. Dalton Trans., 1975, 25. [all data]

Notes

Go To: Top, Condensed phase thermochemistry data, Gas phase ion energetics data, References

• Symbols used in this document:
  

  Cp,solid	Constant pressure heat capacity of solid
  S°solid,1 bar	Entropy of solid at standard conditions (1 bar)

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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