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641571-03-1,MFCD11504832
Catalog No.:AA00EJ58

641571-03-1 | N-BOC-3-Bromo-5-trifluoromethylaniline

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$107.00   $75.00
- +
5g
98%
in stock  
$297.00   $208.00
- +
10g
98%
in stock  
$456.00   $319.00
- +
25g
98%
in stock  
$774.00   $542.00
- +
100g
98%
in stock  
$1,918.00 $1,343.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00EJ58
Chemical Name:
N-BOC-3-Bromo-5-trifluoromethylaniline
CAS Number:
641571-03-1
Molecular Formula:
C12H13BrF3NO2
Molecular Weight:
340.1363
MDL Number:
MFCD11504832
SMILES:
O=C(OC(C)(C)C)Nc1cc(Br)cc(c1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
328  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.1  

Downstream Synthesis Route
754214-56-7    641571-03-1   
tert-butyl(3-(1H-pyrrolo2,3-bpyridin-5-yl)-5-(trifluoromethyl)phenyl)carbamate 

[1]Patent:US2018/208594,2018,A1.Locationinpatent:Paragraph0369-0371

[1]Patent:WO2005/51366,2005,A2

Literature
Quotation Request
Company Name:
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Contact Person:
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Email:
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Quantity Required:
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Country:
Additional Info:
Submit
SDS
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Tags:641571-03-1 Molecular Formula|641571-03-1 MDL|641571-03-1 SMILES|641571-03-1 N-BOC-3-Bromo-5-trifluoromethylaniline
Catalog No.: AA00EJ58
641571-03-1,MFCD11504832
641571-03-1 | N-BOC-3-Bromo-5-trifluoromethylaniline
Pack Size： 1g
Purity： 98%
in stock
$107.00 $75.00
Pack Size： 5g
Purity： 98%
in stock
$297.00 $208.00
Pack Size： 10g
Purity： 98%
in stock
$456.00 $319.00
Pack Size： 25g
Purity： 98%
in stock
$774.00 $542.00
Pack Size： 100g
Purity： 98%
in stock
$1,918.00 $1,343.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00EJ58
Chemical Name: N-BOC-3-Bromo-5-trifluoromethylaniline
CAS Number: 641571-03-1
Molecular Formula: C12H13BrF3NO2
Molecular Weight: 340.1363
MDL Number: MFCD11504832
SMILES: O=C(OC(C)(C)C)Nc1cc(Br)cc(c1)C(F)(F)F
Properties
Complexity: 328  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 19  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.1  
Downstream Synthesis Route
754214-56-7    641571-03-1   
tert-butyl(3-(1H-pyrrolo2,3-bpyridin-5-yl)-5-(trifluoromethyl)phenyl)carbamate 

[1]Patent:US2018/208594,2018,A1.Locationinpatent:Paragraph0369-0371

641571-03-1    641571-21-3 

[1]Patent:WO2005/51366,2005,A2

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