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40874-54-2,MFCD09027425
Catalog No.:AA003434

40874-54-2 | 5-(tert-Butyl)-2-methylbenzoxazole

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$270.00   $189.00
- +
5g
95%
in stock  
$660.00   $462.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003434
Chemical Name:
5-(tert-Butyl)-2-methylbenzoxazole
CAS Number:
40874-54-2
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD09027425
SMILES:
Cc1oc2c(n1)cc(cc2)C(C)(C)C
Properties
Computed Properties
 
Complexity:
209  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
3.8  

Downstream Synthesis Route

[1]Patent:US2429178,1944,

[2]Patent:US2429178,1944,

[1]SyntheticCommunications,2019,vol.49,p.3335-3342

Literature
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Additional Info:
SDS
Tags:40874-54-2 Molecular Formula|40874-54-2 MDL|40874-54-2 SMILES|40874-54-2 5-(tert-Butyl)-2-methylbenzoxazole