5-Hydroxymethylfurfural
- Formula: C6H6O3
- Molecular weight: 126.1100
- IUPAC Standard InChIKey: NOEGNKMFWQHSLB-UHFFFAOYSA-N
- CAS Registry Number: 67-47-0
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: 2-Furancarboxaldehyde, 5-(hydroxymethyl)-; 2-Furaldehyde, 5-(hydroxymethyl)-; HMF; 5-(Hyddroxymethyl)furfurole; 5-(Hydroxymethyl)-2-formylfuran; 5-(Hydroxymethyl)-2-furaldehyde; 5-(Hydroxymethyl)-2-furancarbonal; 5-(Hydroxymethyl)-2-furfural; 5-(Hydroxymethyl)-2-furfuraldehyde; 5-(Hydroxymethyl)furan-2-aldehyde; 5-Hydroxymethylfuraldehyde; 5-Oxymethylfurfurole; 5-Hydroxymethylfurfuraldehyde; 5-Hydroxymethyl-2-furancarbaldehyde; Hydroxymethylfurfuraldehyde; 5-(Hydroxymethyl)-2-furancarboxaldehyde; 2-Hydroxymethyl-5-furfural; NSC 40738; Hydroxymethylfurfural; Hydroxymethylfurfuralaldehyde; 5-(Hydroxymethyl)furan-2-carbaldehyde; 5-Hydroxymethyl-2-furfural (HMF)
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Phase change data
Go To: Top, Mass spectrum (electron ionization), References, Notes
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
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔvapH° | 83.4 ± 0.2 | kJ/mol | GS | Verevkin, Emel'yanenko, et al., 2009 | Based on data from 314. to 368. K.; AC |
Reduced pressure boiling point
Tboil (K) | Pressure (bar) | Reference | Comment |
---|---|---|---|
388.2 | 0.001 | Weast and Grasselli, 1989 | BS |
Enthalpy of fusion
ΔfusH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
19.8 | 308.5 | DSC | Verevkin, Emel'yanenko, et al., 2009 | AC |
Mass spectrum (electron ionization)
Go To: Top, Phase change data, References, Notes
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
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Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | Japan AIST/NIMC Database- Spectrum MS-NW-4745 |
NIST MS number | 231276 |
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.
Verevkin, Emel'yanenko, et al., 2009
Verevkin, Sergey P.; Emel'yanenko, Vladimir N.; Stepurko, Elena N.; Ralys, Richardas V.; Zaitsau, Dmitry H.; Stark, Annegret,
Biomass-Derived Platform Chemicals: Thermodynamic Studies on the Conversion of 5-Hydroxymethylfurfural into Bulk Intermediates,
Ind. Eng. Chem. Res., 2009, 48, 22, 10087-10093, https://doi.org/10.1021/ie901012g
. [all data]
Weast and Grasselli, 1989
CRC Handbook of Data on Organic Compounds, 2nd Editon, Weast,R.C and Grasselli, J.G., ed(s)., CRC Press, Inc., Boca Raton, FL, 1989, 1. [all data]
Notes
Go To: Top, Phase change data, Mass spectrum (electron ionization), References
- Symbols used in this document:
Tboil Boiling point ΔfusH Enthalpy of fusion ΔvapH° Enthalpy of vaporization at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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