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52787-35-6,MFCD20649885
Catalog No.:AA00DNFK

52787-35-6 | Benzeneacetic acid, -alpha--ethyl-4-formyl- (9CI)

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
2 weeks  
$730.00   $511.00
- +
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Technical Information
Catalog Number:
AA00DNFK
Chemical Name:
Benzeneacetic acid, -alpha--ethyl-4-formyl- (9CI)
CAS Number:
52787-35-6
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
MDL Number:
MFCD20649885
SMILES:
CCC(c1ccc(cc1)C=O)C(=O)O
Properties
Computed Properties
 
Complexity:
205  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.8  

Literature
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Additional Info:
SDS
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Tags:52787-35-6 Molecular Formula|52787-35-6 MDL|52787-35-6 SMILES|52787-35-6 Benzeneacetic acid, -alpha--ethyl-4-formyl- (9CI)