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Home Carboxes 25978-68-1
25978-68-1,MFCD11655969
Catalog No.:AA002R6C

25978-68-1 | Methyl 4-cyano-3-methylbenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$37.00   $26.00
- +
5g
98%
in stock  
$47.00   $33.00
- +
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Technical Information
Catalog Number:
AA002R6C
Chemical Name:
Methyl 4-cyano-3-methylbenzoate
CAS Number:
25978-68-1
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
MDL Number:
MFCD11655969
SMILES:
COC(=O)c1ccc(c(c1)C)C#N
Properties
Computed Properties
 
Complexity:
241  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
1.9  

Literature
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Additional Info:
SDS
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Tags:25978-68-1 Molecular Formula|25978-68-1 MDL|25978-68-1 SMILES|25978-68-1 Methyl 4-cyano-3-methylbenzoate