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161171-06-8,MFCD00075394
Catalog No.:AA00ADGD

161171-06-8 | rac trans-4-Cotininecarboxylic Acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
>95.0%(GC)(T)
in stock  
$19.00   $13.00
- +
1g
>95.0%(GC)(T)
in stock  
$62.00   $44.00
- +
5g
>95.0%(GC)(T)
in stock  
$184.00   $129.00
- +
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Technical Information
Catalog Number:
AA00ADGD
Chemical Name:
rac trans-4-Cotininecarboxylic Acid
CAS Number:
161171-06-8
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
MDL Number:
MFCD00075394
SMILES:
OC(=O)[C@H]1CC(=O)N([C@@H]1c1cccnc1)C |&1:2,3,r|
Properties
Computed Properties
 
Complexity:
306  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
2  
XLogP3:
-0.6  

Literature
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Additional Info:
SDS
Tags:161171-06-8 Molecular Formula|161171-06-8 MDL|161171-06-8 SMILES|161171-06-8 rac trans-4-Cotininecarboxylic Acid |Heterocyclic_Building_Blocks