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69226-41-1,MFCD01679515
Catalog No.:AA005WNB

69226-41-1 | Sodium 3-(trifluoromethyl)benzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
96%
in stock  
$7.00   $5.00
- +
25g
96%
in stock  
$24.00   $17.00
- +
100g
96%
in stock  
$86.00   $61.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA005WNB
Chemical Name:
Sodium 3-(trifluoromethyl)benzoate
CAS Number:
69226-41-1
Molecular Formula:
C8H4F3NaO2
Molecular Weight:
212.1011
MDL Number:
MFCD01679515
SMILES:
[O-]C(=O)c1cccc(c1)C(F)(F)F.[Na+]
Properties
Properties
 
BP:
237.7°C at 760 mmHg  
Form:
Solid  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
205  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Downstream Synthesis Route

[1]Wang,Xu-Dong;Deng,Rui-Cheng;Dong,Jing-Jun;Peng,Zhi-Yun;Gao,Xiao-Ming;Li,Shu-Ting;Lin,Wan-Qiang;Lu,Chun-Lei;Xiao,Zhu-Ping;Zhu,Hai-Liang[BioorganicandMedicinalChemistry,2013,vol.21,#17,p.4914-4922]

Literature
Quotation Request
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SDS
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Tags:69226-41-1 Molecular Formula|69226-41-1 MDL|69226-41-1 SMILES|69226-41-1 Sodium 3-(trifluoromethyl)benzoate
Catalog No.: AA005WNB
69226-41-1,MFCD01679515
69226-41-1 | Sodium 3-(trifluoromethyl)benzoate
Pack Size： 5g
Purity： 96%
in stock
$7.00 $5.00
Pack Size： 25g
Purity： 96%
in stock
$24.00 $17.00
Pack Size： 100g
Purity： 96%
in stock
$86.00 $61.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA005WNB
Chemical Name: Sodium 3-(trifluoromethyl)benzoate
CAS Number: 69226-41-1
Molecular Formula: C8H4F3NaO2
Molecular Weight: 212.1011
MDL Number: MFCD01679515
SMILES: [O-]C(=O)c1cccc(c1)C(F)(F)F.[Na+]
Properties
BP: 237.7°C at 760 mmHg  
Form: Solid  
Storage: Keep in dry area;Room Temperature;  
Complexity: 205  
Covalently-Bonded Unit Count: 2  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
Downstream Synthesis Route
1320275-72-6    69226-41-1    1450824-42-6 

[1]Wang,Xu-Dong;Deng,Rui-Cheng;Dong,Jing-Jun;Peng,Zhi-Yun;Gao,Xiao-Ming;Li,Shu-Ting;Lin,Wan-Qiang;Lu,Chun-Lei;Xiao,Zhu-Ping;Zhu,Hai-Liang[BioorganicandMedicinalChemistry,2013,vol.21,#17,p.4914-4922]

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