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42052-61-9,MFCD00019516
Catalog No.:AA00IR32

42052-61-9 | (2E,6E)-2,6-bis(phenylmethylidene)cyclohexan-1-one

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10mg
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$358.00   $250.00
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500mg
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1g
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  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00IR32
Chemical Name:
(2E,6E)-2,6-bis(phenylmethylidene)cyclohexan-1-one
CAS Number:
42052-61-9
Molecular Formula:
C20H18O
Molecular Weight:
274.3563
MDL Number:
MFCD00019516
SMILES:
O=C1/C(=C/c2ccccc2)/CCC/C/1=C\c1ccccc1
Properties
Computed Properties
 
Complexity:
379  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
1  
Rotatable Bond Count:
2  
Undefined Bond Stereocenter Count:
2  
XLogP3:
5.1  

Literature

Title: Efficient regioselective synthesis and potential antitumor evaluation of isoxazolo[5,4-b]pyridines and related annulated compounds.

Journal: Archiv der Pharmazie 20120601

Title: Asymmetrical 2,6-bis(benzylidene)cyclohexanones: Synthesis, cytotoxic activity and QSAR study.

Journal: European journal of medicinal chemistry 20120401

Title: Molecular structure and vibrational spectra of 2,6-bis(benzylidene)cyclohexanone: a density functional theoretical study.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20110101

Title: A novel compound C12 inhibits inflammatory cytokine production and protects from inflammatory injury in vivo.

Journal: PloS one 20110101

Title: (9E)-9-benzylidene-3-methyl-2-methylsulfanyl-5-phenyl-5,6,7,8,9,10-hexahydropyrimido[4,5-b]quinolin-4(3H)-one: polarized molecules within hydrogen-bonded bilayers.

Journal: Acta crystallographica. Section C, Crystal structure communications 20100801

Title: Inhibition of human glutathione S-transferases by curcumin and analogues.

Journal: Xenobiotica; the fate of foreign compounds in biological systems 20090401

Title: cis-2,6-Dibenzyl-cyclo-hexa-none.

Journal: Acta crystallographica. Section E, Structure reports online 20090301

Title: Structure-activity relationships for the inhibition of recombinant human cytochromes P450 by curcumin analogues.

Journal: European journal of medicinal chemistry 20080801

Title: E,E-2-Benzylidene-6-(nitrobenzylidene)cyclohexanones: syntheses, cytotoxicity and an examination of some of their electronic, steric, and hydrophobic properties.

Journal: Bioorganic & medicinal chemistry 20080601

Title: CoMFA and CoMSIA studies on 1,3-bis(benzylidene)-3,4-dihydro-1H-naphthalen-2-one, 2,6-bis(benzylidene)cyclohexanone, and 3,5-bis(benzylidene)-4-piperidone series of cytotoxic compounds.

Journal: Journal of chemical information and modeling 20070101

Title: 2,6-Bis(3,4,5-trihydroxybenzylydene) derivatives of cyclohexanone: novel potent HIV-1 integrase inhibitors that prevent HIV-1 multiplication in cell-based assays.

Journal: Bioorganic & medicinal chemistry 20040102

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Tags:42052-61-9 Molecular Formula|42052-61-9 MDL|42052-61-9 SMILES|42052-61-9 (2E,6E)-2,6-bis(phenylmethylidene)cyclohexan-1-one