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97600-39-0,MFCD00145373
Catalog No.:AA00342K

97600-39-0 | 4-tert-Butylcalix[4]arene-tetraacetic acid tetraethyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$11.00   $8.00
- +
1g
97%
in stock  
$26.00   $18.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA00342K
Chemical Name:
4-tert-Butylcalix[4]arene-tetraacetic acid tetraethyl ester
CAS Number:
97600-39-0
Molecular Formula:
C60H80O12
Molecular Weight:
993.2700
MDL Number:
MFCD00145373
SMILES:
CCOC(=O)COc1c2Cc3cc(cc(c3OCC(=O)OCC)Cc3cc(cc(Cc4c(c(Cc1cc(c2)C(C)(C)C)cc(c4)C(C)(C)C)OCC(=O)OCC)c3OCC(=O)OCC)C(C)(C)C)C(C)(C)C
Properties
Properties
 
BP:
788.39°C (rough estimate)  
Form:
Solid  
MP:
155-158 °C  
Refractive Index:
1.7500 (estimate)  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
1420  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
72  
Hydrogen Bond Acceptor Count:
12  
Rotatable Bond Count:
24  
XLogP3:
15.4  

Literature
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SDS
Tags:97600-39-0 Molecular Formula|97600-39-0 MDL|97600-39-0 SMILES|97600-39-0 4-tert-Butylcalix[4]arene-tetraacetic acid tetraethyl ester