1003709-39-4,MFCD09263434
Catalog No.:AA0001P9

1003709-39-4 | 2-Bromo-4-fluoro-5-methylbenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$8.00   $6.00
- +
1g
98%
in stock  
$27.00   $19.00
- +
5g
97%
in stock  
$39.00   $27.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0001P9
Chemical Name:
2-Bromo-4-fluoro-5-methylbenzoic acid
CAS Number:
1003709-39-4
Molecular Formula:
C8H6BrFO2
Molecular Weight:
233.0344
MDL Number:
MFCD09263434
SMILES:
OC(=O)c1cc(C)c(cc1Br)F
Properties
Computed Properties
 
Complexity:
186  
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:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.6  

Upstream Synthesis Route

[1]Patent:WO2014/76104,2014,A1,.Locationinpatent:Page/Pagecolumn76

Downstream Synthesis Route

[1]Patent:WO2014/76104,2014,A1

[1]Patent:WO2014/76104,2014,A1.Locationinpatent:Page/Pagecolumn76-77

[1]Patent:WO2014/76104,2014,A1

[1]Patent:WO2014/76104,2014,A1

[1]Patent:WO2014/76104,2014,A1

Literature
Quotation Request
Company Name:
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Contact Person:
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Email:
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Quantity Required:
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Additional Info:
SDS
Tags:1003709-39-4 Molecular Formula|1003709-39-4 MDL|1003709-39-4 SMILES|1003709-39-4 2-Bromo-4-fluoro-5-methylbenzoic acid
Catalog No.: AA0001P9
1003709-39-4,MFCD09263434
1003709-39-4 | 2-Bromo-4-fluoro-5-methylbenzoic acid
Pack Size: 250mg
Purity: 97%
in stock
$8.00 $6.00
Pack Size: 1g
Purity: 98%
in stock
$27.00 $19.00
Pack Size: 5g
Purity: 97%
in stock
$39.00 $27.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA0001P9
Chemical Name: 2-Bromo-4-fluoro-5-methylbenzoic acid
CAS Number: 1003709-39-4
Molecular Formula: C8H6BrFO2
Molecular Weight: 233.0344
MDL Number: MFCD09263434
SMILES: OC(=O)c1cc(C)c(cc1Br)F
Properties
Complexity: 186  
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: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.6  
Upstream Synthesis Route
916792-17-1    1003709-39-4 

[1]Patent:WO2014/76104,2014,A1,.Locationinpatent:Page/Pagecolumn76

Downstream Synthesis Route
1003709-39-4    1610472-28-0 

[1]Patent:WO2014/76104,2014,A1

1003709-39-4    1610472-53-1 

[1]Patent:WO2014/76104,2014,A1.Locationinpatent:Page/Pagecolumn76-77

1003709-39-4    1610472-54-2 

[1]Patent:WO2014/76104,2014,A1

1003709-39-4    1610472-55-3 

[1]Patent:WO2014/76104,2014,A1

1003709-39-4    1610472-56-4 

[1]Patent:WO2014/76104,2014,A1

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