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Home Deuterated Building Blocks 4411-25-0
4411-25-0,MFCD00134405
Catalog No.:AA003DUA

4411-25-0 | 1-Adamantyl isocyanate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$80.00   $56.00
- +
5g
97%
in stock  
$254.00   $178.00
- +
10g
97%
in stock  
$445.00   $312.00
- +
25g
97%
in stock  
$858.00   $600.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003DUA
Chemical Name:
1-Adamantyl isocyanate
CAS Number:
4411-25-0
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
MDL Number:
MFCD00134405
SMILES:
O=C=NC12CC3CC(C2)CC(C1)C3
Properties
Properties
 
BP:
309.18°C (rough estimate)  
Form:
Solid  
MP:
144-146 °C(lit.)  
Refractive Index:
1.5302 (estimate)  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
237  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
3.6  

Downstream Synthesis Route

[1]ChemistryLetters,1982,p.565-568

[1]ChemistryLetters,1982,p.565-568

4411-25-0    137730-67-7   
C24H30N2O 

[1]JournalofMedicinalChemistry,1992,vol.35,p.3919-3927

4411-25-0    109635-38-3   
1-Adamantan-1-yl-3-1-(4-chloro-benzyl)-1H-benzoimidazol-2-yl-urea 

[1]DaSettimo;Marini;Primofiore;DaSettimo[IlFarmaco,1995,vol.50,#5,p.321-326]

[1]Patent:WO2006/45119,2006,A2.Locationinpatent:Page/Pagecolumn67-68

Literature

Title: Nanoparticle vesicles through self assembly of cyclodextrin- and adamantyl-modified silica.

Journal: Macromolecular rapid communications 20101215

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Synthesis of (1-adamantylimido)vanadium(V) complexes containing aryloxo, ketimide ligands: effect of ligand substituents in olefin insertion/metathesis polymerization.

Journal: Inorganic chemistry 20080721

Title: Carbonic anhydrase inhibitors: aromatic and heterocyclic sulfonamides incorporating adamantyl moieties with strong anticonvulsant activity.

Journal: Bioorganic & medicinal chemistry 20040515

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SDS
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Tags:4411-25-0 Molecular Formula|4411-25-0 MDL|4411-25-0 SMILES|4411-25-0 1-Adamantyl isocyanate