Home Bromides 1020253-06-8
1020253-06-8,MFCD09972162
Catalog No.:AA0006AK
1020253-06-8 | 4-Bromo-N-tert-butyl-3-(trifluoromethyl)benzenesulfonamide
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250mg
96%
in stock  
$157.00   $110.00
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1g
96%
in stock  
$397.00   $278.00
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Technical Information
Catalog Number:
AA0006AK
Chemical Name:
4-Bromo-N-tert-butyl-3-(trifluoromethyl)benzenesulfonamide
CAS Number:
1020253-06-8
Molecular Formula:
C11H13BrF3NO2S
Molecular Weight:
360.1906
MDL Number:
MFCD09972162
IUPAC Name:
4-bromo-N-tert-butyl-3-(trifluoromethyl)benzenesulfonamide
InChI:
InChI=1S/C11H13BrF3NO2S/c1-10(2,3)16-19(17,18)7-4-5-9(12)8(6-7)11(13,14)15/h4-6,16H,1-3H3
InChI Key:
LOERVVBCAYSQDS-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1C(F)(F)F)S(=O)(=O)NC(C)(C)C
Properties
Computed Properties
 
Complexity:
411  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.98g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
360.189g/mol
Monoisotopic Mass:
358.98g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

Synonyms
 
1020253-06-8 
4-Bromo-N-(tert-butyl)-3-(trifluoromethyl)benzenesulfonamide 
RTR-000517 
AJ-95760 
AX8229692 
TR-000517 
ST24023416 
Z6478 
A-4169 
I01-10760 
4-Bromo-N-(tert-butyl)-3-(trifluoromethyl)-benzenesulfonamide 
4-Bromo-N-tert-butyl-3-(trifluoromethyl)benzene-1-sulfonamide 
4-BROMO-N-TERT-BUTYL-3-(TRIFLUOROMETHYL)BENZENESULFONAMIDE 
Benzenesulfonamide, 4-bromo-N-(1,1-dimethylethyl)-3-(trifluoromethyl)- 
C11H13BrF3NO2S 
ACMC-2097z9 
CTK4A0592 
DTXSID50674371 
ANW-14611 
MFCD09972162 
ZINC38536956 
AKOS015835240 
Literature
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