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54090-42-5,MFCD04638751
Catalog No.:AA00DJI5

54090-42-5 | 4-Chloro-2-(trifluoromethyl)benzenesulphonyl chloride

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$34.00   $24.00
- +
1g
98%
in stock  
$112.00   $78.00
- +
5g
95%
in stock  
$291.00   $204.00
- +
10g
98%
in stock  
$477.00   $334.00
- +
25g
98%
in stock  
$809.00   $567.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DJI5
Chemical Name:
4-Chloro-2-(trifluoromethyl)benzenesulphonyl chloride
CAS Number:
54090-42-5
Molecular Formula:
C7H3Cl2F3O2S
Molecular Weight:
279.0637
MDL Number:
MFCD04638751
SMILES:
Clc1ccc(c(c1)C(F)(F)F)S(=O)(=O)Cl
Properties
Computed Properties
 
Complexity:
322  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
1  
XLogP3:
3.5  

Downstream Synthesis Route
107-10-8    13331-27-6    54090-42-5    7693-46-1   
(S)-2-(4-Chloro-2-trifluoromethyl-benzenesulfonylamino)-3-3'-(3-propyl-ureido)-biphenyl-4-yl-propionicacid 

[1]Urbahns,Klaus;Haerter,Michael;Vaupel,Andrea;Albers,Markus;Schmidt,Delf;Brueggemeier,Ulf;Stelte-Ludwig,Beatrix;Gerdes,Christoph;Tsujishita,Hideki[BioorganicandMedicinalChemistryLetters,2003,vol.13,#6,p.1071-1074]

54090-42-5   
2-(3-(3-methoxypyridin-4-yl)phenyl)propan-2-aminehydrochloride 
 
4-chloro-N-(2-(3-(3-methoxypyridin-4-yl)phenyl)propan-2-yl)-2-(trifluoromethyl)benzenesulfonamide 

[1]CurrentPatentAssignee:VENENUMBIODESIGN-WO2018/5801,2018,A2Locationinpatent:Page/Pagecolumn133-134;138

54090-42-5   
tert-butyl(S)-(4-amino-1-(4-cyano-3-fluorophenoxy)butan-2-yl)carbamate 
 
C23H24ClF4N3O5S 

[1]Patterson,JaclynR.;Terrell,LamontR.;Donatelli,CarlaA.;Holt,DennisA.;Jolivette,LarryJ.;Rivero,RalphA.;Roethke,TheresaJ.;Shu,Arthur;Stoy,Patrick;Ye,Guosen;Youngman,Mark;Lawhorn,BrianG.[JournalofMedicinalChemistry,2020]

54090-42-5   
tert-butyl(S)-(4-amino-1-(4-cyano-3-fluorophenoxy)butan-2-yl)carbamate 
 
(S)-N-(3-amino-4-(4-cyano-3-fluorophenoxy)butyl)-4-chloro-2-(trifluoromethyl)benzenesulfonamide 

[1]Patterson,JaclynR.;Terrell,LamontR.;Donatelli,CarlaA.;Holt,DennisA.;Jolivette,LarryJ.;Rivero,RalphA.;Roethke,TheresaJ.;Shu,Arthur;Stoy,Patrick;Ye,Guosen;Youngman,Mark;Lawhorn,BrianG.[JournalofMedicinalChemistry,2020]

Literature
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SDS
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Tags:54090-42-5 Molecular Formula|54090-42-5 MDL|54090-42-5 SMILES|54090-42-5 4-Chloro-2-(trifluoromethyl)benzenesulphonyl chloride