Musk ketone

• Formula: C₁₄H₁₈N₂O₅
• Molecular weight: 294.3031
• IUPAC Standard InChI: InChI=1S/C14H18N2O5/c1-7-10(9(3)17)8(2)13(16(20)21)11(14(4,5)6)12(7)15(18)19/h1-6H3 Copy

  
• IUPAC Standard InChIKey: WXCMHFPAUCOJIG-UHFFFAOYSA-N Copy
• CAS Registry Number: 81-14-1
• Chemical structure:
  This structure is also available as a 2d Mol file
• Other names: Acetophenone, 4'-tert-butyl-2',6'-dimethyl-3',5'-dinitro-; 4'-tert-Butyl-2',6'-dimethyl-3',5'-dinitroacetophenone; Ketone Moschus; Ethanone, 1-[4-(1,1-dimethylethyl)-2,6-dimethyl-3,5-dinitrophenyl]-; 2,6-Dinitro-3,5-dimethyl-4-acetyl-tertbutylbenzene; 4-tert-Butyl-3,5-dinitro-2,6-dimethylacetophenone; 4-tert-Butyl-2,6-dimethyl-3,5-dinitroacetophenone; 1-Acetyl-4-tert-butyl-2,6-dimethyl-3,5-dinitrobenzene; 1-[4-(1,1-Dimethylethyl)-2,6-dimethyl-3,5-dinitrophenyl]ethanone; 4-t-Butyl-2,6-dimethyl-3,5-dinitroacetophenone; 4-tert-Butyl-2,6-dimethyl-3,5-dinitroactophenone; Ketone musk; 3,5-Dinitro-2,6-dimethyl-4-tert-butyl acetophenone; 2,6-Dimethyl-3,5-dinitro-4-t-butylacetophenone; NSC 15339; 2,6-Dimethyl-3,5-dinitro-4-tert-butylacetophenone
• Permanent link for this species. Use this link for bookmarking this species for future reference.
• Information on this page:
  • Phase change data
  • Mass spectrum (electron ionization)
  • References
  • Notes
• Other data available:
  • Gas Chromatography
• Options:
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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: William E. Acree, Jr., James S. Chickos

Enthalpy of sublimation

Enthalpy of fusion

Mass spectrum (electron ionization)

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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: NIST Mass Spectrometry Data Center, William E. Wallace, director

Spectrum

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Additional Data

References

Go To: Top, Phase change data, Mass spectrum (electron ionization), Notes

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

Serpinskii, Voitkevich, et al., 1953
Serpinskii, V.V.; Voitkevich, S.A.; Lyuboshits, N.Y., Zh. Fiz. Khim., 1953, 27, 1032. [all data]

Jones, 1960
Jones, A.H., Sublimation Pressure Data for Organic Compounds., J. Chem. Eng. Data, 1960, 5, 2, 196-200, https://doi.org/10.1021/je60006a019 . [all data]

Qu, Bai, et al., 2004
Qu, H.; Bai, P.; Yang, Z.; Yu, G., Chin. J. Chem. Eng., 2004, 12, 2, 294. [all data]

Notes

Go To: Top, Phase change data, Mass spectrum (electron ionization), References

• Symbols used in this document:
  

  ΔfusH	Enthalpy of fusion
  ΔsubH	Enthalpy of sublimation

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