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13531-48-1,MFCD00220156
Catalog No.:AA003RP9

13531-48-1 | Methyl 3-cyanobenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$18.00   $13.00
- +
25g
98%
in stock  
$45.00   $32.00
- +
100g
95%
in stock  
$74.00   $52.00
- +
  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA003RP9
Chemical Name:
Methyl 3-cyanobenzoate
CAS Number:
13531-48-1
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
MDL Number:
MFCD00220156
SMILES:
COC(=O)c1cccc(c1)C#N
Properties
Properties
 
BP:
267.2°C at 760 mmHg  
Form:
Solid  
MP:
58 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
216  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
1.8  

Literature
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Additional Info:
SDS
Tags:13531-48-1 Molecular Formula|13531-48-1 MDL|13531-48-1 SMILES|13531-48-1 Methyl 3-cyanobenzoate