4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile]
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![4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile] structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/c184a4777ea84a5f837e0303eadbea44.png "4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile]")
4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile]
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CAS No:
130755-46-3
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Formula:
C22H8Cl4F6N8S2
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Chemical Name:
4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile]
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Synonyms:
1H-Pyrazole-3-carbonitrile,4,4′-dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-;4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile]
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CAS No:
4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile] Basic Attributes
704.28500
704.28
423-490-1|603-434-4
DTXSID50456811
Characteristics
185.86000
9.57876
1.83g/cm3
>300 °C
733.1ºC at 760 mmHg
397.1ºC
1.707
2.39E-21mmHg at 25°C
Safety Information
R50/53
60-61
N
|Warning|H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]|P273, P391, and P501|H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]|Aggregated GHS information provided by 87 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H373 (100%): Causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]|P260, P273, P314, P391, and P501|Aggregated GHS information provided by 35 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H410: Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
Computed Properties
Molecular Weight:704.3
XLogP3:7.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:5
Exact Mass:703.894214
Monoisotopic Mass:701.897164
Topological Polar Surface Area:186
Heavy Atom Count:42
Complexity:971
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of 4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile]
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