Isoflurophate
- Formula: C6H14FO3P
- Molecular weight: 184.1457
- IUPAC Standard InChI: InChI=1S/C6H14FO3P/c1-5(2)9-11(7,8)10-6(3)4/h5-6H,1-4H3
- IUPAC Standard InChIKey: MUCZHBLJLSDCSD-UHFFFAOYSA-N
- CAS Registry Number: 55-91-4
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Other names: Diisopropyl fluorophosphate; Phosphorofluoridic acid, bis(1-methylethyl) ester; DFP; Diflurophate; Diflupyl; Diisopropoxyphosphoryl fluoride; Diisopropylfluorfosfat; O,O-Diisopropyl fluorophosphate; Diisopropyl fluorophosphonate; Diisopropylfluorophosphoric acid ester; Diisopropylfluorphosphorsaeureester; Diisopropyl phosphofluoridate; Diisopropyl phosphorofluoridate; O,O'-Diisopropyl phosphoryl fluoride; Dyflos; EA 1152; Floropryl; Fluophosphoric acid, diisopropyl ester; Fluorodiisopropyl phosphate; Fluostigmine; Fluoropryl; Isofluorophate; Isopropyl fluophosphate; Isopropyl phosphorofluoridate; Neoglaucit; PF-3; Phosphorofluoridic acid, diisopropyl ester; Rcra waste number P043; T-1703; TL 466; Disiopropyl fluorophosphonate; Fluropryl; Isofluorphate; Fluorophosphoric acid, diisopropyl ester
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Phase change data
Go To: Top, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, 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: William E. Acree, Jr., James S. Chickos
Enthalpy of vaporization
| ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
|---|---|---|---|---|
| 7.03 | 288. | A | Stephenson and Malanowski, 1987 | Based on data from 273. to 348. K. |
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.
Condensed Phase Spectrum
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Additional Data
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| Owner | Public domain |
|---|---|
| Origin | Pacific Northwest National Laboratory Under IARPA Contract |
| Date | March 2017 |
| State | liquid |
| Instrument | Bruker Tensor 27 FTIR |
| Instrument resolution | 2.0 cm-1 |
| IR source | Silicon carbide glow bar |
| Aperture | 3 mm |
| Beam splitter | Broadband potassium bromide (KBr) |
| Detector | DLTGS at room temperature |
| Scanner velocity | 10 kHz |
| Phase correction | Mertz |
| Interferogram zero fill | 4x |
| Spectral interval after zero fill | 0.4823 cm-1 |
| Spectral range | 7800 to 400 cm-1 (1.282 to 25 microns) |
| Resolution | 0.48212986 |
| Apodization | Norton-Beer, Medium |
| Folding limits | 15802 to 0 cm-1 |
| Number of interferograms averaged per single channel spectrum | 128 |
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
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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 | VERIFIN - Methodology B4-1983 |
| NIST MS number | 226257 |
Gas Chromatography
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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
Kovats' RI, non-polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Capillary | Methyl Silicone | 100. | 927. | Huber, Kenndler, et al., 1993 | H2; Column length: 5. m; Phase thickness: 2.65 μm |
| Capillary | Methyl Silicone | 120. | 926. | Huber, Kenndler, et al., 1993 | H2; Column length: 5. m; Phase thickness: 2.65 μm |
| Capillary | Methyl Silicone | 80. | 929. | Huber, Kenndler, et al., 1993 | H2; Column length: 5. m; Phase thickness: 2.65 μm |
Kovats' RI, polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Capillary | PEG-20M | 110. | 1342. | Huber, Kenndler, et al., 1993 | Column length: 10. m; Phase thickness: 1.33 μm |
| Capillary | PEG-20M | 90. | 1341. | Huber, Kenndler, et al., 1993 | Column length: 10. m; Phase thickness: 1.33 μm |
| Capillary | PEG-20M | 130. | 1342.4 | Huber, Kenndler, et al., 1993 | Column length: 10. m; Phase thickness: 1.33 μm |
References
Go To: Top, Phase change data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Stephenson and Malanowski, 1987
Stephenson, Richard M.; Malanowski, Stanislaw,
Handbook of the Thermodynamics of Organic Compounds, 1987, https://doi.org/10.1007/978-94-009-3173-2
. [all data]
Huber, Kenndler, et al., 1993
Huber, J.F.K.; Kenndler, E.; Reich, G.; Hack, W.; Wolf, J.,
Optimal Selection of Gas Chromatographic Columns for the Analytical Control of Chemical Warfare Agents by Application of Information Theory to Retention Data,
Anal. Chem., 1993, 65, 20, 2903-2906, https://doi.org/10.1021/ac00068a031
. [all data]
Notes
Go To: Top, Phase change data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, References
- Symbols used in this document:
ΔvapH Enthalpy of vaporization - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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