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Home Aldehydes 117569-57-0
117569-57-0,MFCD07187866
Catalog No.:AA0081EO

117569-57-0 | 4-(3-Hydroxy-3-methylbut-1-yn-1-yl)benzaldehyde

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$40.00   $28.00
- +
5g
95%
in stock  
$161.00   $113.00
- +
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Technical Information
Catalog Number:
AA0081EO
Chemical Name:
4-(3-Hydroxy-3-methylbut-1-yn-1-yl)benzaldehyde
CAS Number:
117569-57-0
Molecular Formula:
C12H12O2
Molecular Weight:
188.2225
MDL Number:
MFCD07187866
SMILES:
O=Cc1ccc(cc1)C#CC(O)(C)C
Properties
Computed Properties
 
Complexity:
259  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.5  

Literature
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Additional Info:
SDS
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Tags:117569-57-0 Molecular Formula|117569-57-0 MDL|117569-57-0 SMILES|117569-57-0 4-(3-Hydroxy-3-methylbut-1-yn-1-yl)benzaldehyde