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80172-04-9,MFCD00153280
Catalog No.:AA005CH6

80172-04-9 | 3,4,5-Trifluorobenzotrifluoride

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$56.00   $39.00
- +
5g
97%
in stock  
$142.00   $99.00
- +
25g
97%
in stock  
$458.00   $320.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA005CH6
Chemical Name:
3,4,5-Trifluorobenzotrifluoride
CAS Number:
80172-04-9
Molecular Formula:
C7H2F6
Molecular Weight:
200.0812
MDL Number:
MFCD00153280
SMILES:
Fc1c(F)cc(cc1F)C(F)(F)F
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
164  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.1  

Upstream Synthesis Route

[1]Patent:US2006/9643,2006,A1,.Locationinpatent:Page/Pagecolumn5

Downstream Synthesis Route

[1]Patent:US2005/148649,2005,A1.Locationinpatent:Page/Pagecolumn22

[1]Patent:US2006/9643,2006,A1.Locationinpatent:Page/Pagecolumn5

[1]Patent:US5457104,1995,A

80172-04-9   
2,6-difluoro-4-(trifluoromethyl)aniline 

[1]Patent:US4952601,1990,A

[2]Patent:US5082971,1992,A

80172-04-9   
petrol-diethylether 
  50650-59-4   
1-(2,6-difluoro-4-trifluoromethylphenyl)-4-trifluoromethyl-2-pyridone 

[1]Patent:US4725607,1988,A

Literature
Quotation Request
Company Name:
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Additional Info:
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SDS
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Tags:80172-04-9 Molecular Formula|80172-04-9 MDL|80172-04-9 SMILES|80172-04-9 3,4,5-Trifluorobenzotrifluoride
Catalog No.: AA005CH6
80172-04-9,MFCD00153280
80172-04-9 | 3,4,5-Trifluorobenzotrifluoride
Pack Size： 1g
Purity： 97%
in stock
$56.00 $39.00
Pack Size： 5g
Purity： 97%
in stock
$142.00 $99.00
Pack Size： 25g
Purity： 97%
in stock
$458.00 $320.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA005CH6
Chemical Name: 3,4,5-Trifluorobenzotrifluoride
CAS Number: 80172-04-9
Molecular Formula: C7H2F6
Molecular Weight: 200.0812
MDL Number: MFCD00153280
SMILES: Fc1c(F)cc(cc1F)C(F)(F)F
Properties
Storage: Keep in dry area;2-8℃;  
Complexity: 164  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.1  
Upstream Synthesis Route
50594-82-6    80172-04-9 

[1]Patent:US2006/9643,2006,A1,.Locationinpatent:Page/Pagecolumn5

Downstream Synthesis Route
80172-04-9    856226-47-6 

[1]Patent:US2005/148649,2005,A1.Locationinpatent:Page/Pagecolumn22

50594-82-6    80172-04-9 

[1]Patent:US2006/9643,2006,A1.Locationinpatent:Page/Pagecolumn5

80172-04-9    157337-92-3 

[1]Patent:US5457104,1995,A

80172-04-9   
2,6-difluoro-4-(trifluoromethyl)aniline 

[1]Patent:US4952601,1990,A

[2]Patent:US5082971,1992,A

80172-04-9   
petrol-diethylether 
  50650-59-4   
1-(2,6-difluoro-4-trifluoromethylphenyl)-4-trifluoromethyl-2-pyridone 

[1]Patent:US4725607,1988,A

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Submit
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