3',4'-(Methylenedioxy)acetophenone

• Formula: C₉H₈O₃
• Molecular weight: 164.1580
• IUPAC Standard InChI: InChI=1S/C9H8O3/c1-6(10)7-2-3-8-9(4-7)12-5-11-8/h2-4H,5H2,1H3 Copy

  
• IUPAC Standard InChIKey: BMHMKWXYXFBWMI-UHFFFAOYSA-N Copy
• CAS Registry Number: 3162-29-6
• 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: 3,4-Methylenedioxyacetophenone; Acetopiperone; Ethanone, 1-(1,3-benzodioxol-5-yl)-; 3,4-Methylen-dioxy-acetophenon; 3,4-Methylenedioxycetophenone; 1-(1,3-benzodioxol-5-yl)ethan-1-one
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• Information on this page:
  • Phase change data
  • IR Spectrum
  • Mass spectrum (electron ionization)
  • References
  • Notes
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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 as indicated in comments:
BS - Robert L. Brown and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos

Reduced pressure boiling point

Enthalpy of fusion

IR Spectrum

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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

Gas Phase Spectrum

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Additional Data

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

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

Matos, Sousa, et al., 2007
Matos, M. Agostinha R.; Sousa, Clara C.S.; Morais, Victor M.F., Experimental and Computational Thermochemistry of 1,3-Benzodioxole Derivatives, J. Chem. Eng. Data, 2007, 52, 3, 1089-1094, https://doi.org/10.1021/je700035m . [all data]

Frinton Laboratories Inc., 1986
Frinton Laboratories Inc., Catalog Number 11, Frinton Laboratories Inc., Vineland, NJ, 1986, 99. [all data]

Notes

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• Symbols used in this document:
  

  Tboil	Boiling point
  ΔfusH	Enthalpy of fusion
  ΔsubH°	Enthalpy of sublimation at standard conditions

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