1215205-96-1,MFCD15143584
Catalog No.:AA00153K

1215205-96-1 | 1-Bromo-3-(methylsulfonyl)-5-(trifluoromethyl)benzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$162.00   $114.00
- +
5g
98%
in stock  
$567.00 $397.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00153K
Chemical Name:
1-Bromo-3-(methylsulfonyl)-5-(trifluoromethyl)benzene
CAS Number:
1215205-96-1
Molecular Formula:
C8H6BrF3O2S
Molecular Weight:
303.0962
MDL Number:
MFCD15143584
SMILES:
Brc1cc(cc(c1)S(=O)(=O)C)C(F)(F)F
Properties
Computed Properties
 
Complexity:
320  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
15  
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  
XLogP3:
2.7  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2012/232051,2012,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2012/117000,2012,A1

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2012/232051,2012,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2012/117000,2012,A1

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2012/232051,2012,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2012/117000,2012,A1

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2012/232051,2012,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2012/117000,2012,A1

[3]CurrentPatentAssignee:ROCHEHOLDINGAG-US2013/267519,2013,A1

[4]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/149977,2013,A1

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2013/267519,2013,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/149977,2013,A1

Literature
Quotation Request
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Additional Info:
SDS
Tags:1215205-96-1 Molecular Formula|1215205-96-1 MDL|1215205-96-1 SMILES|1215205-96-1 1-Bromo-3-(methylsulfonyl)-5-(trifluoromethyl)benzene
Catalog No.: AA00153K
1215205-96-1,MFCD15143584
1215205-96-1 | 1-Bromo-3-(methylsulfonyl)-5-(trifluoromethyl)benzene
Pack Size: 1g
Purity: 98%
in stock
$162.00 $114.00
Pack Size: 5g
Purity: 98%
in stock
$567.00 $397.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00153K
Chemical Name: 1-Bromo-3-(methylsulfonyl)-5-(trifluoromethyl)benzene
CAS Number: 1215205-96-1
Molecular Formula: C8H6BrF3O2S
Molecular Weight: 303.0962
MDL Number: MFCD15143584
SMILES: Brc1cc(cc(c1)S(=O)(=O)C)C(F)(F)F
Properties
Complexity: 320  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 15  
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  
XLogP3: 2.7  
Downstream Synthesis Route
1215205-96-1    1395414-21-7 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2012/232051,2012,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2012/117000,2012,A1

1215205-96-1    1395414-22-8 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2012/232051,2012,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2012/117000,2012,A1

1215205-96-1    1395414-23-9 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2012/232051,2012,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2012/117000,2012,A1

1215205-96-1    53985-43-6 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2012/232051,2012,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2012/117000,2012,A1

[3]CurrentPatentAssignee:ROCHEHOLDINGAG-US2013/267519,2013,A1

[4]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/149977,2013,A1

1215205-96-1    1395416-72-4 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2013/267519,2013,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/149977,2013,A1

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