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Home Other Building Blocks 97678-86-9
97678-86-9,MFCD00171556
Catalog No.:AA00IJWA

97678-86-9 | (E)-4-(4-(tert-Butyl)phenyl)-4-oxobut-2-enoic acid

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Purity
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Price(USD)
Quantity
  
100mg
in stock  
$100.00   $70.00
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Technical Information
Catalog Number:
AA00IJWA
Chemical Name:
(E)-4-(4-(tert-Butyl)phenyl)-4-oxobut-2-enoic acid
CAS Number:
97678-86-9
Molecular Formula:
C14H16O3
Molecular Weight:
232.2750
MDL Number:
MFCD00171556
SMILES:
O=C(c1ccc(cc1)C(C)(C)C)/C=C/C(=O)O
Properties
Computed Properties
 
Complexity:
315  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.2  

Literature
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Additional Info:
SDS
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Tags:97678-86-9 Molecular Formula|97678-86-9 MDL|97678-86-9 SMILES|97678-86-9 (E)-4-(4-(tert-Butyl)phenyl)-4-oxobut-2-enoic acid