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Home Carboxes 42858-60-6
42858-60-6,MFCD09836162
Catalog No.:AA00BXP4

42858-60-6 | 3,5-Dioxocyclohexanecarboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$14.00   $10.00
- +
1g
95%
in stock  
$40.00   $28.00
- +
5g
95%
in stock  
$167.00   $117.00
- +
10g
97%
in stock  
$209.00   $146.00
- +
25g
97%
in stock  
$520.00   $364.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BXP4
Chemical Name:
3,5-Dioxocyclohexanecarboxylic acid
CAS Number:
42858-60-6
Molecular Formula:
C7H8O4
Molecular Weight:
156.1360
MDL Number:
MFCD09836162
SMILES:
O=C1CC(=O)CC(C1)C(=O)O
Properties
Computed Properties
 
Complexity:
203  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
-0.8  

Downstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2009,vol.19,p.356-359

[2]JournaloftheAmericanChemicalSociety,1959,vol.81,p.4278,4283    OrganicSyntheses,1973,vol.Coll.Vol.V,p.400

[3]Patent:US2020/190066,2020,A1.Locationinpatent:Paragraph0339-0340

[1]JournaloftheAmericanChemicalSociety,1956,vol.78,p.4405,4410

[2]AngewandteChemie-InternationalEdition,2015,vol.54,p.1011-1015    Angew.Chem.,2014,vol.127,p.1025-1029,5

[1]BioorganicandMedicinalChemistryLetters,2009,vol.19,p.356-359

[2]ChemischeBerichte,1955,vol.88,p.316,327

[1]AustralianJournalofChemistry,1954,vol.7,p.256,259

42858-60-6    142-04-1   
3-anilino-5-oxo-cyclohex-3-enecarboxylicacid 

[1]ChemischeBerichte,1955,vol.88,p.316,327

Literature
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SDS
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