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5653-46-3,MFCD00016498
Catalog No.:AA0036Z5

5653-46-3 | 2-Hydroxy-3,4-dimethoxybenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
500mg
97%
1 week  
$151.00   $106.00
- +
1g
97%
1 week  
$172.00   $120.00
- +
  • 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:
AA0036Z5
Chemical Name:
2-Hydroxy-3,4-dimethoxybenzoic acid
CAS Number:
5653-46-3
Molecular Formula:
C9H10O5
Molecular Weight:
198.1727
MDL Number:
MFCD00016498
SMILES:
COc1c(OC)ccc(c1O)C(=O)O
NSC Number:
37414
Properties
Properties
 
BP:
334.2°C at 760 mmHg  
Form:
Solid  
MP:
170-172 °C  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
205  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
1.9  

Upstream Synthesis Route

[1]Patent:WO2014/31784,2014,A1,.Locationinpatent:Paragraph0408

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,#12,p.3319-3322

[2]JournaloftheChemicalSociety,1938,p.1602,1605

[1]Tetrahedron,2008,vol.64,#46,p.10552-10557

[1]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2008,vol.47,#12,p.1898-1902

[1]MonatsheftefuerChemie,1904,vol.25,p.513

[2]JustusLiebigsAnnalenderChemie,1905,vol.340,p.230

[3]MonatsheftefuerChemie,1904,vol.25,p.513

Downstream Synthesis Route

[1]JournaloftheChemicalSociety,1938,p.756

[1]MonatsheftefurChemie,1902,vol.23,p.707    MonatsheftefuerChemie,1904,vol.25,p.506

[1]Patent:US6048864,2000,A

[2]JournaloftheChemicalSociety,1952,p.4589

[1]Patent:WO2014/96018,2014,A1.Locationinpatent:Page/Pagecolumn33

[2]JournaloftheChemicalSociety,1952,p.4589

50-00-0    5653-46-3   
6,6'-dihydroxy-4,5,4',5'-tetramethoxy-3,3'-methanediyl-di-benzoicacid 

[1]JournaloftheChemicalSociety,1942,p.726

Literature
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SDS
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