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69049-86-1,MFCD07700900
Catalog No.:AA00FBPM

69049-86-1 | 2-(tert-Butylcarbamoyl)cyclohexanecarboxylic acid

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Technical Information
Catalog Number:
AA00FBPM
Chemical Name:
2-(tert-Butylcarbamoyl)cyclohexanecarboxylic acid
CAS Number:
69049-86-1
Molecular Formula:
C12H21NO3
Molecular Weight:
227.3000
MDL Number:
MFCD07700900
SMILES:
O=C(C1CCCCC1C(=O)O)NC(C)(C)C
Properties
Computed Properties
 
Complexity:
281  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
2  
XLogP3:
1.6  

Literature
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SDS
Tags:69049-86-1 Molecular Formula|69049-86-1 MDL|69049-86-1 SMILES|69049-86-1 2-(tert-Butylcarbamoyl)cyclohexanecarboxylic acid