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3696-12-6,MFCD00137632
Catalog No.:AA00I78E

3696-12-6 | 2-(4-Hydroxy-3-methoxybenzylidene)malononitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
1 week  
$299.00   $209.00
- +
5mg
>90%
1 week  
$319.00   $223.00
- +
10mg
>90%
1 week  
$358.00   $250.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00I78E
Chemical Name:
2-(4-Hydroxy-3-methoxybenzylidene)malononitrile
CAS Number:
3696-12-6
Molecular Formula:
C11H8N2O2
Molecular Weight:
200.1934
MDL Number:
MFCD00137632
SMILES:
N#CC(=Cc1ccc(c(c1)OC)O)C#N
NSC Number:
61936
Properties
Computed Properties
 
Complexity:
326  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.7  

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: Tyrphostins I: synthesis and biological activity of protein tyrosine kinase inhibitors.

Journal: Journal of medicinal chemistry 19891001

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SDS
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Tags:3696-12-6 Molecular Formula|3696-12-6 MDL|3696-12-6 SMILES|3696-12-6 2-(4-Hydroxy-3-methoxybenzylidene)malononitrile
Catalog No.: AA00I78E
3696-12-6,MFCD00137632
3696-12-6 | 2-(4-Hydroxy-3-methoxybenzylidene)malononitrile
Pack Size： 1mg
Purity： >90%
1 week
$299.00 $209.00
Pack Size： 5mg
Purity： >90%
1 week
$319.00 $223.00
Pack Size： 10mg
Purity： >90%
1 week
$358.00 $250.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00I78E
Chemical Name: 2-(4-Hydroxy-3-methoxybenzylidene)malononitrile
CAS Number: 3696-12-6
Molecular Formula: C11H8N2O2
Molecular Weight: 200.1934
MDL Number: MFCD00137632
SMILES: N#CC(=Cc1ccc(c(c1)OC)O)C#N
NSC Number: 61936
Properties
Complexity: 326  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.7  
Literature fold

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

Journal: Bioorganic & medicinal chemistry letters20101101

Title: Tyrphostins I: synthesis and biological activity of protein tyrosine kinase inhibitors.

Journal: Journal of medicinal chemistry19891001

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