Myclobutanil
- Formula: C15H17ClN4
- Molecular weight: 288.775
- IUPAC Standard InChI: InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3
- IUPAC Standard InChIKey: HZJKXKUJVSEEFU-UHFFFAOYSA-N
- CAS Registry Number: 88671-89-0
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: α-butyl-α-(4-chlorophenyl)-1H-1,2,4-triazole-1-propanenitrile; Nova; Rally; RH-3866; Systhane; 1H-1,2,4-Triazole-1-propanenitrile, α-butyl-α-(4-chlorophenyl)-; a-butyl-a-(4-chlorophenyl)-1H-1,2,4-triazole-1-propanenitrile; α-butyl-α-(4-chlorophenyl)-1H-1,2,4-triazole-1-propanenitrile (myclobutanil)
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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 fusion
| ΔfusH (kcal/mol) | Temperature (K) | Reference |
|---|---|---|
| 7.392 | 348.8 | Sun, Liu, et al., 2005 |
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
Normal alkane RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | Siloxane, 5 % Ph | 2210. | VOC BinBase, 2012 | Program: not specified |
| Capillary | Polydimethyl siloxane, 5 % phenyl | 2210. | Skogerson, Wohlgemuth, et al., 2011 | Program: not specified |
| Capillary | 5 % Phenyl methyl siloxane | 2198. | Department of Food Safety and Welfare, 2006 | 30. m/0.25 mm/0.25 μm, Helium; Program: 50 0C(1 min) 25 0C/min -> 125 0C 10 0C/min -> 300 0C (10 min) |
| Capillary | 5 % Phenyl methyl siloxane | 2198. | Department of Food Safety and Welfare, 2006 | 30. m/0.25 mm/0.25 μm, Helium; Program: 50 0C(1 min) 25 0C/min -> 125 0C 10 0C/min -> 300 0C (10 min) |
References
Go To: Top, Phase change data, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Sun, Liu, et al., 2005
Sun, Xiao-Hong; Liu, Yuan-Fa; Tan, Zhi-Cheng; Jia, Ying-Qi; Wang, Mei-Han; Di, You-Ying,
Heat Capacity and Thermodynamic Properties of Myclobutanil,
Chin. J. Chem., 2005, 23, 1, 23-27, https://doi.org/10.1002/cjoc.200590006
. [all data]
VOC BinBase, 2012
VOC BinBase,
The volatile compound BinBase (VOC BinBase), 2012, retrieved from http://fiehnlab.ucdavis.edu/projects/VocBinBase and http://binbase.sourceforge.net. [all data]
Skogerson, Wohlgemuth, et al., 2011
Skogerson, K.; Wohlgemuth, G.; Fiehn, O.,
VocBinNase, 2011, retrieved from http://fiehnlab.ucdavis.edu/projects//VocBinBase. [all data]
Department of Food Safety and Welfare, 2006
Department of Food Safety, Ministry of Health; Welfare,
Analytical methods for residual compositional substances of agricultural chemicals, feed aadditives, and veterinary drugs in foods, 2006, retrieved from http://www.mhlw.go.jp/english/topics/foodsafety/positivelist060228/de/060526-1a.pdf. [all data]
Notes
Go To: Top, Phase change data, Gas Chromatography, References
- Symbols used in this document:
ΔfusH Enthalpy of fusion - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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