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2949-26-0,MFCD00870424
Catalog No.:AA002YHU

2949-26-0 | 2-Ethynyl-naphthalene

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100mg
98%
in stock  
$6.00   $4.00
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250mg
98%
in stock  
$8.00   $6.00
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1g
98%
in stock  
$12.00   $8.00
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5g
98%
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$46.00   $32.00
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10g
98%
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$90.00   $63.00
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25g
98%
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$220.00   $154.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002YHU
Chemical Name:
2-Ethynyl-naphthalene
CAS Number:
2949-26-0
Molecular Formula:
C12H8
Molecular Weight:
152.1919
MDL Number:
MFCD00870424
SMILES:
C#Cc1ccc2c(c1)cccc2
Properties
Computed Properties
 
Complexity:
195  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Rotatable Bond Count:
1  
XLogP3:
3.7  

Downstream Synthesis Route

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2949-26-0   
(E)-2-4-(2-naphthyl)but-3-en-1-ynylnaphthalene 

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2949-26-0    140-88-5   
ethyl5-(2-naphthalenyl)pent-4-ynoate 

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4519-46-4    2949-26-0    925-90-6   
1-bromo-2-(2-naphthalen-1-yl-pent-2-enyl)cyclopropane-1,2-dicarboxylicaciddimethylester 

[1]Synlett,2005,p.911-914

Literature

Title: Structure-Function Studies of Naphthalene, Phenanthrene, Biphenyl, and Their Derivatives in Interaction with and Oxidation by Cytochromes P450 2A13 and 2A6.

Journal: Chemical research in toxicology 20160620

Title: Unimolecular dissociation of anthracene and acridine cations: the importance of isomerization barriers for the C2H2 loss and HCN loss channels.

Journal: The Journal of chemical physics 20110828

Title: Syntheses and reactivity of naphthalenyl-substituted arenediynes.

Journal: Organic letters 20110715

Title: Addition of one and two units of C2H to styrene: a theoretical study of the C10H9 and C12H9 systems and implications toward growth of polycyclic aromatic hydrocarbons at low temperatures.

Journal: The Journal of chemical physics 20110114

Title: Reverse type I binding spectra of human cytochrome P450 1B1 induced by flavonoid, stilbene, pyrene, naphthalene, phenanthrene, and biphenyl derivatives that inhibit catalytic activity: a structure-function relationship study.

Journal: Chemical research in toxicology 20090701

Title: Inhibition of CYP2B4 by 2-ethynylnaphthalene: evidence for the co-binding of substrate and inhibitor within the active site.

Journal: Archives of biochemistry and biophysics 20071215

Title: Inhibition of CYP2B4 by the mechanism-based inhibitor 2-ethynylnaphthalene: inhibitory potential of 2EN is dependent on the size of the substrate.

Journal: Archives of biochemistry and biophysics 20070601

Title: Cytochrome p450 enzymes mechanism based inhibitors: common sub-structures and reactivity.

Journal: Current drug metabolism 20051001

Title: The functional role of threonine-205 in the mechanism-based inactivation of P450 2B1 by two ethynyl substrates: the importance of the F helix in catalysis.

Journal: The Journal of pharmacology and experimental therapeutics 20041201

Title: Threonine-205 in the F helix of p450 2B1 contributes to androgen 16 beta-hydroxylation activity and mechanism-based inactivation.

Journal: The Journal of pharmacology and experimental therapeutics 20030801

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