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138642-93-0,MFCD00045859
Catalog No.:AA0018US

138642-93-0 | 3-Cyano-4-methylbenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
1 week  
$210.00   $147.00
- +
500mg
97%
1 week  
$277.00   $194.00
- +
1g
97%
1 week  
$364.00   $255.00
- +
5g
97%
1 week  
$1,154.00   $808.00
- +
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Technical Information
Catalog Number:
AA0018US
Chemical Name:
3-Cyano-4-methylbenzoic acid
CAS Number:
138642-93-0
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
MDL Number:
MFCD00045859
SMILES:
N#Cc1cc(ccc1C)C(=O)O
Properties
Computed Properties
 
Complexity:
228  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.5  

Literature
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Additional Info:
SDS
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Tags:138642-93-0 Molecular Formula|138642-93-0 MDL|138642-93-0 SMILES|138642-93-0 3-Cyano-4-methylbenzoic acid