Home Bromides 1020253-03-5
1020253-03-5,MFCD09972159
Catalog No.:AA0006AN
1020253-03-5 | N,N-Diethyl 4-bromo-3-trifluoromethylbenzenesulfonamide
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Purity
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250mg
97%
in stock  
$172.00   $120.00
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1g
97%
in stock  
$397.00   $278.00
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5g
97%
in stock  
$1,508.00   $1,055.00
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  • Technical Information
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Technical Information
Catalog Number:
AA0006AN
Chemical Name:
N,N-Diethyl 4-bromo-3-trifluoromethylbenzenesulfonamide
CAS Number:
1020253-03-5
Molecular Formula:
C11H13BrF3NO2S
Molecular Weight:
360.1906
MDL Number:
MFCD09972159
IUPAC Name:
4-bromo-N,N-diethyl-3-(trifluoromethyl)benzenesulfonamide
InChI:
InChI=1S/C11H13BrF3NO2S/c1-3-16(4-2)19(17,18)8-5-6-10(12)9(7-8)11(13,14)15/h5-7H,3-4H2,1-2H3
InChI Key:
YWTSSKIFTPDTJV-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)c1ccc(c(c1)C(F)(F)F)Br)CC
Properties
Computed Properties
 
Complexity:
390  
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:
0
Isotope Atom Count:
0
Molecular Weight:
360.189g/mol
Monoisotopic Mass:
358.98g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

Synonyms
 
1020253-03-5 
4-Bromo-N,N-diethyl-3-(trifluoromethyl)benzenesulfonamide 
RTR-000514 
AJ-95764 
AX8230455 
TR-000514 
ST24023407 
Z6475 
I01-10758 
N,N-Diethyl-4-bromo-3-trifluoromethylbenzenesulfonamide 
4-Bromo-N,N-diethyl-3-(trifluoromethyl)-benzenesulfonamide 
N,N-Diethyl 4-bromo-3-(trifluoromethyl)benzenesulfonamide 
N,N-Diethyl 4-bromo-3-trifluoromethylbenzenesulfonamide 
4-Bromo-N,N-diethyl-3-(trifluoromethyl)benzene-1-sulfonamide 
Benzenesulfonamide, 4-bromo-N,N-diethyl-3-(trifluoromethyl)- 
C11H13BrF3NO2S 
A-4166 
ACMC-2097z6 
CTK4A0589 
DTXSID90674375 
ANW-14608 
MFCD09972159 
ZINC38536960 
AKOS015835219 
Literature
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