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55886-48-1,MFCD00010806
Catalog No.:AA003DLN

55886-48-1 | 2-Methylcyclohexa-2,5-dienecarboxylic acid

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003DLN
Chemical Name:
2-Methylcyclohexa-2,5-dienecarboxylic acid
CAS Number:
55886-48-1
Molecular Formula:
C8H10O2
Molecular Weight:
138.1638
MDL Number:
MFCD00010806
SMILES:
OC(=O)C1C=CCC=C1C
Properties
Computed Properties
 
Complexity:
201  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.3  

Downstream Synthesis Route

[1]CurrentPatentAssignee:COMMONWEALTHSYSTEMOFHIGHEREDUCATION-US2022/89508,2022,A1Locationinpatent:Paragraph0106-0107

[2]Kaliappan,KrishnaP.;SubbaRao[JournaloftheChemicalSociety.PerkintransactionsI,1997,#9,p.1385-1389]

[3]Birch[JournaloftheChemicalSociety,1950,p.1551,1554]

[4]SubbaRao,G.S.R.;Vijaybhaskar,K.;Srikrishna,A.[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1986,vol.25,p.785-786]

[5]Rao,G.S.R.Subba;Bhaskar,K.Vijaya[JournaloftheChemicalSociety.PerkintransactionsI,1993,#19,p.2333-2338]

[6]CurrentPatentAssignee:COMMONWEALTHSYSTEMOFHIGHEREDUCATION-US2022/89508,2022,A1

[7]Davison,Nathan;Quirk,JamesA.;Tuna,Floriana;Collison,David;McMullin,ClaireL.;Michaels,Hannes;Morritt,GeorgeH.;Waddell,PaulG.;Gould,JamieA.;Freitag,Marina;Dawson,JamesA.;Lu,Erli[Chem,2023,vol.9,#3,p.576-591]

[8]Davison,Nathan;Quirk,JamesA.;Tuna,Floriana;Collison,David;McMullin,ClaireL.;Michaels,Hannes;Morritt,GeorgeH.;Waddell,PaulG.;Gould,JamieA.;Freitag,Marina;Dawson,JamesA.;Lu,Erli[Chem,2023,vol.9,#3,p.576-591]

[9]Gao,Yunpeng;Kubota,Koji;Ito,Hajime[AngewandteChemie-InternationalEdition,2023,vol.62,#21][Angew.Chem.,2023,vol.135,#21]

Literature

Title: Probing lipid peroxidation by using linoleic acid and benzophenone.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20110829

Title: Oxidative effects induced by dediazoniation of the p-hydroxybenzenediazonium ion in a neutral aqueous medium.

Journal: Journal of chromatography. A 20040507

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SDS
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