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99768-21-5,MFCD22549347
Catalog No.:AA00IK97

99768-21-5 | 4-Bromo-1-methanesulfonyl-2-methylbenzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
96%
in stock  
$131.00   $92.00
- +
5g
96%
in stock  
$456.00 $319.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00IK97
Chemical Name:
4-Bromo-1-methanesulfonyl-2-methylbenzene
CAS Number:
99768-21-5
Molecular Formula:
C8H9BrO2S
Molecular Weight:
249.1249
MDL Number:
MFCD22549347
SMILES:
Brc1ccc(c(c1)C)S(=O)(=O)C
Properties
Computed Properties
 
Complexity:
242  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.7  

Downstream Synthesis Route

[1]ChemischeBerichte,1959,vol.92,p.2887,2891

[1]ChemischeBerichte,1959,vol.92,p.2887,2891

[2]ChemischeBerichte,1959,vol.92,p.2887,2891

[1]Patent:US2009/23702,2009,A1.Locationinpatent:Page/Pagecolumn101

[1]Patent:US2009/23702,2009,A1.Locationinpatent:Page/Pagecolumn101

[1]Patent:WO2013/14060,2013,A1.Locationinpatent:Page/Pagecolumn58

[2]Patent:US2013/29949,2013,A1.Locationinpatent:Paragraph0181;0182;0183

Literature
Quotation Request
Company Name:
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Contact Person:
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Quantity Required:
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Additional Info:
Submit
SDS
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Tags:99768-21-5 Molecular Formula|99768-21-5 MDL|99768-21-5 SMILES|99768-21-5 4-Bromo-1-methanesulfonyl-2-methylbenzene
Catalog No.: AA00IK97
99768-21-5,MFCD22549347
99768-21-5 | 4-Bromo-1-methanesulfonyl-2-methylbenzene
Pack Size： 1g
Purity： 96%
in stock
$131.00 $92.00
Pack Size： 5g
Purity： 96%
in stock
$456.00 $319.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00IK97
Chemical Name: 4-Bromo-1-methanesulfonyl-2-methylbenzene
CAS Number: 99768-21-5
Molecular Formula: C8H9BrO2S
Molecular Weight: 249.1249
MDL Number: MFCD22549347
SMILES: Brc1ccc(c(c1)C)S(=O)(=O)C
Properties
Complexity: 242  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.7  
Downstream Synthesis Route
89981-03-3    99768-21-5 

[1]ChemischeBerichte,1959,vol.92,p.2887,2891

14092-00-3    99768-21-5 

[1]ChemischeBerichte,1959,vol.92,p.2887,2891

[2]ChemischeBerichte,1959,vol.92,p.2887,2891

116632-39-4    20277-69-4    99768-21-5 

[1]Patent:US2009/23702,2009,A1.Locationinpatent:Page/Pagecolumn101

1101873-47-5    99768-21-5    1104450-19-2 

[1]Patent:US2009/23702,2009,A1.Locationinpatent:Page/Pagecolumn101

139937-37-4    79-08-3    99768-21-5 

[1]Patent:WO2013/14060,2013,A1.Locationinpatent:Page/Pagecolumn58

[2]Patent:US2013/29949,2013,A1.Locationinpatent:Paragraph0181;0182;0183

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