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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] structure

CAS No:
130755-46-3
Formula:
C22H8Cl4F6N8S2
Chemical Name:
4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile]
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]
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile] Basic Attributes

Molecular Weight：

704.28500

Exact Mass：

704.28

EC Number：

423-490-1|603-434-4

DSSTox ID：

DTXSID50456811

Characteristics

PSA：

185.86000

XLogP3：

9.57876

Density：

1.83g/cm3

Melting Point：

>300 °C

Boiling Point：

733.1ºC at 760 mmHg

Flash Point：

397.1ºC

Refractive Index：

1.707

Vapor Pressure：

2.39E-21mmHg at 25°C

Safety Information

hazard class code：

R50/53

safety instructions：

60-61

Marks：

GHS Classification：

|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]

Hangzhou KieRay Chem Co.,LTD Contact Supplier

CN
5 YRS

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4,4'-dithiobis(5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-1H-pyrazole-3-carbonitrile)

CAS No.: 130755-46-3

Grade: industrial Grade

Content: 98%

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Guide of 4,4′-Dithiobis[5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrile]

Basic Attributes
Characteristics
Safety Information
Computed Properties
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Latest News
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