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86776-54-7,MFCD17019212
Catalog No.:AA0038YE

86776-54-7 | 4-Cyano-3-fluorophenyl-4-heptylbenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$28.00   $19.00
- +
250mg
95%
in stock  
$30.00   $21.00
- +
1g
95%
in stock  
$46.00   $32.00
- +
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Technical Information
Catalog Number:
AA0038YE
Chemical Name:
4-Cyano-3-fluorophenyl-4-heptylbenzoate
CAS Number:
86776-54-7
Molecular Formula:
C21H22FNO2
Molecular Weight:
339.4033
MDL Number:
MFCD17019212
SMILES:
CCCCCCCc1ccc(cc1)C(=O)Oc1ccc(c(c1)F)C#N
Properties
Computed Properties
 
Complexity:
450  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
9  
XLogP3:
6.7  

Literature
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Additional Info:
SDS
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Tags:86776-54-7 Molecular Formula|86776-54-7 MDL|86776-54-7 SMILES|86776-54-7 4-Cyano-3-fluorophenyl-4-heptylbenzoate