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18940-21-1,MFCD00128479
Catalog No.:AA002DKX

18940-21-1 | 3-Anilino-5,5-dimethyl-2-cyclohexen-1-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$83.00   $58.00
- +
1g
98%
in stock  
$150.00   $105.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA002DKX
Chemical Name:
3-Anilino-5,5-dimethyl-2-cyclohexen-1-one
CAS Number:
18940-21-1
Molecular Formula:
C14H17NO
Molecular Weight:
215.2909
MDL Number:
MFCD00128479
SMILES:
O=C1C=C(CC(C1)(C)C)Nc1ccccc1
Properties
Computed Properties
 
Complexity:
298  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
3  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS
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Tags:18940-21-1 Molecular Formula|18940-21-1 MDL|18940-21-1 SMILES|18940-21-1 3-Anilino-5,5-dimethyl-2-cyclohexen-1-one