Benzoyl isocyanate

• Formula: C₈H₅NO₂
• Molecular weight: 147.1308
• IUPAC Standard InChI: InChI=1S/C8H5NO2/c10-6-9-8(11)7-4-2-1-3-5-7/h1-5H Copy

  
• IUPAC Standard InChIKey: LURYMYITPCOQAU-UHFFFAOYSA-N Copy
• CAS Registry Number: 4461-33-0
• Chemical structure:
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• Other names: Methanone, 1-phenyl-1-isocyanato-
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• Information on this page:
  • Phase change data
  • Gas phase ion energetics data
  • References
  • Notes
• Other data available:
  • IR Spectrum
  • Mass spectrum (electron ionization)
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Phase change 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: Robert L. Brown and Stephen E. Stein

Reduced pressure boiling point

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 and Joel F. Liebman

Ionization energy determinations

References

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

Buckingham and Donaghy, 1982
Buckingham, J.; Donaghy, S.M., Dictionary of Organic Compounds: Fifth Edition, Chapman and Hall, New York, 1982, 1. [all data]

Zverev, Il'yasov, et al., 1991
Zverev, V.V.; Il'yasov, A.V.; Aminova, R.M.; Zobova, N.N.; Sagitova, R.N., ¹³C NMR spectra and photoelectron spectra of acyl isocyanates, J. Gen. Chem. USSR, 1991, 61, 1031. [all data]

Notes

Go To: Top, Phase change data, Gas phase ion energetics data, References

• Symbols used in this document:
  

  Tboil	Boiling point
  Tfus	Fusion (melting) point

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