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85916-13-8,MFCD01863672
Catalog No.:AA0034PK

85916-13-8 | Di-tert-butyl iminodiacetate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$12.00   $8.00
- +
5g
97%
in stock  
$164.00   $115.00
- +
10g
97%
in stock  
$296.00   $207.00
- +
25g
97%
in stock  
$581.00   $407.00
- +
  • 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:
AA0034PK
Chemical Name:
Di-tert-butyl iminodiacetate
CAS Number:
85916-13-8
Molecular Formula:
C12H23NO4
Molecular Weight:
245.3153
MDL Number:
MFCD01863672
SMILES:
O=C(OC(C)(C)C)CNCC(=O)OC(C)(C)C
Properties
Properties
 
BP:
298°C at 760 mmHg  
Form:
Solid  
MP:
38-42 °C(lit.)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
245  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
8  
XLogP3:
1.6  

Upstream Synthesis Route

[1]Patent:CN108191686,2018,A,.Locationinpatent:Paragraph0040-0073

[1]JournalofOrganicChemistry,2003,vol.68,#10,p.3999-4007

[2]Patent:US9217117,2015,B2,.Locationinpatent:Page/Pagecolumn28

[3]Patent:EP522547,1993,A2,

[1]Patent:EP522547,1993,A2,

[1]Patent:US2012/149632,2012,A1,

[1]JournalofOrganicChemistry,2003,vol.68,#10,p.3999-4007

Downstream Synthesis Route

[1]HelveticaChimicaActa,1992,vol.75,p.1621-1632

[1]ActachemicaScandinavica.SeriesB:Organicchemistryandbiochemistry,1988,vol.42,p.373-377

[2]JournaloftheAmericanChemicalSociety,2007,vol.129,p.14138-14139

[1]HelveticaChimicaActa,1992,vol.75,p.1621-1632

[1]HelveticaChimicaActa,1992,vol.75,p.1578-1592

[1]HelveticaChimicaActa,1992,vol.75,p.1621-1632

Literature
Quotation Request
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SDS
Tags:85916-13-8 Molecular Formula|85916-13-8 MDL|85916-13-8 SMILES|85916-13-8 Di-tert-butyl iminodiacetate