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Home Fluorides 157652-31-8
157652-31-8,MFCD07777153
Catalog No.:AA001PJ5

157652-31-8 | 3,4-Difluoro-2-methylbenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$6.00   $4.00
- +
1g
97%
in stock  
$8.00   $6.00
- +
5g
97%
in stock  
$19.00   $14.00
- +
10g
97%
in stock  
$37.00   $26.00
- +
25g
97%
in stock  
$92.00   $64.00
- +
100g
97%
in stock  
$365.00   $256.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001PJ5
Chemical Name:
3,4-Difluoro-2-methylbenzoic acid
CAS Number:
157652-31-8
Molecular Formula:
C8H6F2O2
Molecular Weight:
172.1288
MDL Number:
MFCD07777153
SMILES:
OC(=O)c1ccc(c(c1C)F)F
Properties
Properties
 
BP:
268°C at 760 mmHg  
Form:
Solid  
MP:
152-156℃  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
184  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2  

Upstream Synthesis Route

[1]Patent:US2005/54733,2005,A1,.Locationinpatent:Page/Pagecolumn4

[1]JournalofMedicinalChemistry,2013,vol.56,#6,p.2218-2234

[2]Patent:US2005/54733,2005,A1,.Locationinpatent:Page/Pagecolumn3;4

[3]Patent:WO2010/125102,2010,A1,.Locationinpatent:Page/Pagecolumn95

[1]OrganicProcessResearchandDevelopment,2015,vol.19,#7,p.721-734

[1]JournalofMedicinalChemistry,2013,vol.56,#6,p.2218-2234

[2]OrganicProcessResearchandDevelopment,2015,vol.19,#7,p.721-734

Downstream Synthesis Route

[1]Patent:US2005/54733,2005,A1.Locationinpatent:Page/Pagecolumn4

[2]Patent:WO2014/159224,2014,A1.Locationinpatent:Paragraph00165

[1]Patent:US2005/54733,2005,A1.Locationinpatent:Page/Pagecolumn4

[2]Patent:WO2019/214610,2019,A1

[1]JournalofMedicinalChemistry,2013,vol.56,p.2218-2234

[2]Patent:US2005/54733,2005,A1.Locationinpatent:Page/Pagecolumn3;4

[3]Patent:WO2010/125102,2010,A1.Locationinpatent:Page/Pagecolumn95

[1]Patent:WO2010/125102,2010,A1.Locationinpatent:Page/Pagecolumn96

Literature
Quotation Request
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Additional Info:
SDS
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