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542-54-1,MFCD00001967
Catalog No.:AA003R0R

542-54-1 | Isocapronitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$62.00   $44.00
- +
5g
98%
in stock  
$145.00   $102.00
- +
25g
98%
in stock  
$477.00   $334.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA003R0R
Chemical Name:
Isocapronitrile
CAS Number:
542-54-1
Molecular Formula:
C6H11N
Molecular Weight:
97.1582
MDL Number:
MFCD00001967
SMILES:
N#CCCC(C)C
NSC Number:
6109
Properties
Properties
 
BP:
156.5°C  
Form:
Liquid  
MP:
-51°  
Refractive Index:
1.4050-1.4070  
Storage:
Room Temperature;Keep in dry area;  

Computed Properties
 
Complexity:
75.4  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.5  

Literature
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Additional Info:
SDS
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Tags:542-54-1 Molecular Formula|542-54-1 MDL|542-54-1 SMILES|542-54-1 Isocapronitrile |Organic_Building_Blocks