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20921-96-4,MFCD02181139
Catalog No.:AA002K0E

20921-96-4 | Methyl (2-cyanophenyl)acetate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$23.00   $16.00
- +
5g
98%
in stock  
$63.00   $44.00
- +
25g
98%
in stock  
$267.00   $187.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002K0E
Chemical Name:
Methyl (2-cyanophenyl)acetate
CAS Number:
20921-96-4
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
MDL Number:
MFCD02181139
SMILES:
COC(=O)Cc1ccccc1C#N
Properties
Computed Properties
 
Complexity:
228  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
3  
XLogP3:
1.4  

Downstream Synthesis Route

[1]JournalofOrganicChemistry,1953,vol.18,p.30,33

[1]Qiao;Meutermans;Wong;Traubel;Wentrup[JournaloftheAmericanChemicalSociety,1996,vol.118,#16,p.3852-3861]

[1]Qiao;Meutermans;Wong;Traubel;Wentrup[JournaloftheAmericanChemicalSociety,1996,vol.118,#16,p.3852-3861]

[1]Qiao;Meutermans;Wong;Traubel;Wentrup[JournaloftheAmericanChemicalSociety,1996,vol.118,#16,p.3852-3861]

[1]Qiao;Meutermans;Wong;Traubel;Wentrup[JournaloftheAmericanChemicalSociety,1996,vol.118,#16,p.3852-3861]

Literature
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Additional Info:
SDS
Tags:20921-96-4 Molecular Formula|20921-96-4 MDL|20921-96-4 SMILES|20921-96-4 Methyl (2-cyanophenyl)acetate