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37589-22-3,MFCD01673970
Catalog No.:AA00C70I

37589-22-3 | 1-Phenyl-3-adamantanecarboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$412.00   $288.00
- +
5g
95%
in stock  
$1,642.00   $1,149.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA00C70I
Chemical Name:
1-Phenyl-3-adamantanecarboxylic acid
CAS Number:
37589-22-3
Molecular Formula:
C17H20O2
Molecular Weight:
256.3395
MDL Number:
MFCD01673970
SMILES:
OC(=O)C12CC3CC(C1)CC(C2)(C3)c1ccccc1
Properties
Properties
 
BP:
408.8°C at 760 mmHg  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
380  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
2  
XLogP3:
3.9  

Literature
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SDS
Tags:37589-22-3 Molecular Formula|37589-22-3 MDL|37589-22-3 SMILES|37589-22-3 1-Phenyl-3-adamantanecarboxylic acid