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939-27-5,MFCD00004127
Catalog No.:AA003383

939-27-5 | 2-Ethylnaphthalene

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1g
99% GC
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$18.00   $13.00
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5g
99% GC
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25g
99% GC
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$208.00   $146.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003383
Chemical Name:
2-Ethylnaphthalene
CAS Number:
939-27-5
Molecular Formula:
C12H12
Molecular Weight:
156.2237
MDL Number:
MFCD00004127
SMILES:
CCc1ccc2c(c1)cccc2
NSC Number:
59389
Properties
Properties
 
BP:
257.8°C at 760 mmHg  
Form:
Solid  
MP:
−70 °C(lit.)  
Refractive Index:
n20/D 1.599(lit.)  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
139  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Rotatable Bond Count:
1  
XLogP3:
4.4  

Downstream Synthesis Route

[1]JournaloftheAmericanChemicalSociety,1948,vol.70,p.4026,4030

[2]JournaloftheAmericanChemicalSociety,1948,vol.70,p.4026,4030

[3]JournaloftheAmericanChemicalSociety,1948,vol.70,p.4026,4030

[1]ChemischeBerichte,1934,vol.67,p.67

[1]Pluim,Henk;Wynberg,Hans[JournalofOrganicChemistry,1980,vol.45,#12,p.2498-2502]

[2]Fieseretal.[JournaloftheAmericanChemicalSociety,1939,vol.61,p.3216,3220]Sah[RecueildesTravauxChimiquesdesPays-Bas,1940,vol.59,p.1029,1034]

[3]Kruber;Schade[ChemischeBerichte,1936,vol.69,p.1722,1726]

[4]Manecke,G.etal.[ChemischeBerichte,1967,vol.100,p.836-844]

[1]Zhou,Min-Jie;Zhang,Lei;Liu,Guixia;Xu,Chen;Huang,Zheng[JournaloftheAmericanChemicalSociety,2021,vol.143,#40,p.16470-16485]

[2]CurrentPatentAssignee:I.G.FARBENINDUSTRIEAG(historic)-US1985844,1931,A

[3]Kutzetal.[JournaloftheAmericanChemicalSociety,1948,vol.70,p.4026,4030]Salkind;Arbusowa[PlasticheskieMassy,1939,#3,p.249][Chem.Abstr.,1942,p.2548]

[4]Kutzetal.[JournaloftheAmericanChemicalSociety,1948,vol.70,p.4026,4030]Salkind;Arbusowa[PlasticheskieMassy,1939,#3,p.249][Chem.Abstr.,1942,p.2548]

[5]Klemm,L.H.etal.[JournalofOrganicChemistry,1962,vol.27,p.2777-2786]

[1]Mueller,Andreas;Amsharov,KonstantinYu.[EuropeanJournalofOrganicChemistry,2012,#31,p.6155-6164,10]

[2]Fuson;Chadwick[JournalofOrganicChemistry,1948,vol.13,p.484,485]

[3]Goldenberg,C.etal.[ChimicaTherapeutica,1972,vol.7,p.369-377]

[4]Hayashi,Tamio;Hayashizaki,Keiichi;Kiyoi,Takao;Ito,Yoshihiko[JournaloftheAmericanChemicalSociety,1988,vol.110,p.8153-8156]

[5]Huang,Shenlin;Kötzner,Lisa;KantaDe,Chandra;List,Benjamin[JournaloftheAmericanChemicalSociety,2015,vol.137,#10,p.3446-3449]

Literature

Title: Alkylation effects on the energy transfer of highly vibrationally excited naphthalene.

Journal: Chemistry, an Asian journal 20111104

Title: Exploring QSAR and QAAR for inhibitors of cytochrome P450 2A6 and 2A5 enzymes using GFA and G/PLS techniques.

Journal: European journal of medicinal chemistry 20090501

Title: Predicting survival of grass shrimp (Palaemonetes pugio) exposed to naphthalene, fluorene, and dibenzothiophene.

Journal: Environmental toxicology and chemistry 20080801

Title: Equilibrium in-fiber standardization method for determination of sample volume by solid phase microextraction.

Journal: The Analyst 20070501

Title: Dicarbonyl products of the OH radical-initiated reactions of naphthalene and the Cl- and C2-alkylnaphthalenes.

Journal: Environmental science & technology 20070415

Title: Predicting survival of grass shrimp (Palaemonetes pugio) during ethylnaphthalene, dimethylnaphthalene, and phenanthrene exposures differing in concentration and duration.

Journal: Environmental toxicology and chemistry 20070301

Title: Multisubstrate biodegradation kinetics for binary and complex mixtures of polycyclic aromatic hydrocarbons.

Journal: Environmental toxicology and chemistry 20060701

Title: Reactions of chlorine atoms with a series of aromatic hydrocarbons.

Journal: Environmental science & technology 20050715

Title: Predictive three-dimensional quantitative structure-activity relationship of cytochrome P450 1A2 inhibitors.

Journal: Journal of medicinal chemistry 20050602

Title: Quantitative structure-activity relationship analysis of inhibitors of the nicotine metabolizing CYP2A6 enzyme.

Journal: Journal of medicinal chemistry 20050127

Title: 2-Substituted adenosine derivatives: affinity and efficacy at four subtypes of human adenosine receptors.

Journal: Biochemical pharmacology 20041115

Title: Anaerobic oxidation of crude oil hydrocarbons by the resident microorganisms of a contaminated anoxic aquifer.

Journal: Environmental science & technology 20031115

Title: D2 dopaminergic and 5-HT1A serotonergic activity of 2-(1-naphthyl)ethyl- and 2-(2-naphthyl)ethyl amines.

Journal: Archiv der Pharmazie 20031101

Title: Probing the binding dynamics to sodium cholate aggregates using naphthalene derivatives as guests.

Journal: Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20031101

Title: Rate constants for the gas-phase reactions of a series of alkylnaphthalenes with the nitrate radical.

Journal: Environmental science & technology 20030115

Title: Rate constants for the gas-phase reactions of a series of alkylnaphthalenes with the OH radical.

Journal: Environmental science & technology 20020501

Title: Metalloporphyrin-mediated asymmetric nitrogen-atom transfer to hydrocarbons: aziridination of alkenes and amidation of saturated C-H bonds catalyzed by chiral ruthenium and manganese porphyrins.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20020402

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