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Home Other Building Blocks 6802-75-1
6802-75-1,MFCD00009147
Catalog No.:AA003PE2

6802-75-1 | Diethyl isopropylidenemalonate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
95%
in stock  
$11.00   $8.00
- +
25g
95%
in stock  
$28.00   $20.00
- +
500g
95%
in stock  
$445.00   $312.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003PE2
Chemical Name:
Diethyl isopropylidenemalonate
CAS Number:
6802-75-1
Molecular Formula:
C10H16O4
Molecular Weight:
200.2316
MDL Number:
MFCD00009147
SMILES:
CCOC(=O)C(=C(C)C)C(=O)OCC
Properties
Properties
 
BP:
242.8°C at 760 mmHg  
Form:
Liquid  
Refractive Index:
n20/D 1.451(lit.)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
229  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
6  
XLogP3:
2.4  

Downstream Synthesis Route

[1]ChemischeBerichte,1915,vol.48,p.261

[2]ChemischeBerichte,1915,vol.48,p.261

[1]ChemischeBerichte,1915,vol.48,p.261

[1]SyntheticCommunications,2010,vol.40,p.342-350

[2]ArkivfoerKemi,1947,vol.23B,p.3

[3]JournaloftheAmericanChemicalSociety,1953,vol.75,p.2949

[4]JournaloftheAmericanChemicalSociety,1969,vol.91,p.2703-2715

[5]JournalofOrganicChemistry,1967,vol.32,p.3950-3955

[6]AustralianJournalofChemistry,1974,vol.27,p.1693-1710

[7]JournaloftheChemicalSociety.PerkintransactionsI,1984,p.1241-1246

[8]ChemischeBerichte,1986,vol.119,p.1196-1207

[9]JournalofMolecularStructure,1987,vol.162,p.321-332

[10]EuropeanJournalofOrganicChemistry,2013,p.7044-7049

[1]CurrentPatentAssignee:VERTEXPHARMACEUTICALS(OLD)-WO2022/76622,2022,A2Locationinpatent:Paragraph00872

[2]Gol'mow;Malewannaja[ZhurnalObshcheiKhimii,1958,vol.28,p.3075;engl.Ausg.S.3106]

[1]Patent:US2017/114080,2017,A1.Locationinpatent:Paragraph0485

[2]Patent:WO2018/200625,2018,A1.Locationinpatent:Paragraph00372;00337;00374

[3]ZhurnalObshcheiKhimii,1958,vol.28,p.3075;engl.Ausg.S.3106

Literature

Title: Calyculins and related marine natural products as serine-threonine protein phosphatase PP1 and PP2A inhibitors and total syntheses of calyculin A, B, and C.

Journal: Marine drugs 20100101

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SDS
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Tags:6802-75-1 Molecular Formula|6802-75-1 MDL|6802-75-1 SMILES|6802-75-1 Diethyl isopropylidenemalonate