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504-02-9,MFCD00001585
Catalog No.:AA0032IL

504-02-9 | Cyclohexane-1,3-dione

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25g
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$7.00   $5.00
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100g
97%
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500g
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  • 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:
AA0032IL
Chemical Name:
Cyclohexane-1,3-dione
CAS Number:
504-02-9
Molecular Formula:
C6H8O2
Molecular Weight:
112.1265
MDL Number:
MFCD00001585
SMILES:
O=C1CCCC(=O)C1
NSC Number:
57477
Properties
Properties
 
BP:
235.1°C at 760 mmHg  
Form:
Solid  
MP:
101-105 °C(lit.)  
Refractive Index:
1.4576 (estimate)  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
113  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  

Upstream Synthesis Route

[1]JournalofMassSpectrometry,1998,vol.33,#3,p.229-241

[2]SyntheticCommunications,1999,vol.29,#18,p.3097-3106

[3]JournaloftheChemicalSociety-PerkinTransactions1,1999,#13,p.1885-1892

[4]JournaloftheChemicalSociety,ChemicalCommunications,1993,#4,p.364-365

[5]JournaloftheAmericanChemicalSociety,1986,vol.108,#24,p.7575-7579

[6]Patent:WO2017/199199,2017,A1,.Locationinpatent:Page/Pagecolumn20;21

[7]AngewandteChemie-InternationalEdition,2016,vol.55,#5,p.1816-1819

[8]Angew.Chem.,2016,vol.128,#5,p.1848-1851,4

[9]Patent:CN101160049,2016,B,.Locationinpatent:Paragraph1130-1133

[10]ChemMedChem,2013,vol.8,#6,p.967-975

[11]Pharmazie,1983,vol.38,#12,p.851-854

[12]JournalofChemicalCrystallography,1999,vol.29,#8,p.977-982

[13]ChemMedChem,2015,vol.10,#1,p.47-51

[1]JournaloftheAmericanChemicalSociety,1952,vol.74,p.3331

[1]TetrahedronLetters,1989,vol.30,#11,p.1311-1314

[1]Patent:CN107235891,2017,A,

[1]JournalofChemicalResearch,Miniprint,1995,#11,p.2557-2568

[2]OrganicLetters,2016,vol.18,#5,p.1178-1181

Downstream Synthesis Route

[1]Patent:CN110128382,2019,A.Locationinpatent:Paragraph0008;0089-0091

[2]ARKIVOC,2011,vol.2011,p.1-14

[3]Heterocycles,2004,vol.62,p.807-813

[4]BioorganicandMedicinalChemistry,2008,vol.16,p.1966-1982

[5]JournalofOrganicChemistry,1988,vol.53,p.4135-4137

[6]ChemicalandPharmaceuticalBulletin,1994,vol.42,p.2167-2169

[7]Tetrahedron,1996,vol.52,p.8169-8180

[8]JournalofMedicinalChemistry,2007,vol.50,p.2818-2841

[9]ChemistryLetters,2008,vol.37,p.822-823

[10]BeilsteinJournalofOrganicChemistry,2018,vol.14,p.2853-2860

[1]SyntheticCommunications,1986,vol.16,p.1635-1640

2826-91-7    504-02-9   
2-hydroxyimino-3-(2-methylindol-3-yl)-2,3,4,5,6,7-hexahydrobenzofuran-4-one 

[1]RussianJournalofOrganicChemistry,2001,vol.37,p.1505-1506

58028-76-5    504-02-9   
1,2,4,4a,5,6-hexahydrospiro1,4oxazino4,3-aquinoline-5,2'-cyclohexane-1',3'-dione 

[1]RussianChemicalBulletin,2004,vol.53,p.1240-1247

2657-25-2    504-02-9   
2-(4-hydroxyphenyl)-4-phenyl-5-oxo-5,6,7,8-tetrahydro-2-chromene 

[1]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2005,vol.44,p.622-624

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Tags:504-02-9 Molecular Formula|504-02-9 MDL|504-02-9 SMILES|504-02-9 Cyclohexane-1,3-dione |Organic_Building_Blocks