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2039-66-9,MFCD00192585
Catalog No.:AA00293O

2039-66-9 | 2-(2-Aminoethyl)phenol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$69.00   $48.00
- +
5g
95%
in stock  
$321.00   $225.00
- +
10g
95%
in stock  
$640.00   $448.00
- +
25g
98%
in stock  
$1,345.00 $942.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00293O
Chemical Name:
2-(2-Aminoethyl)phenol
CAS Number:
2039-66-9
Molecular Formula:
C8H11NO
Molecular Weight:
137.1790
MDL Number:
MFCD00192585
SMILES:
NCCc1ccccc1O
Properties
Properties
 
BP:
258°C at 760 mmHg  
Form:
Solid  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
95.3  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1  

Downstream Synthesis Route

[1]Locationinpatent:experimentalpartHellal,Malik;Singh,Shambhavi;Cuny,GregoryD.[Tetrahedron,2012,vol.68,#6,p.1674-1681]

[2]Kondo;Tanaka[YakugakuZasshi/JournalofthePharmaceuticalSocietyofJapan,1932,vol.52,p.608,610;dtsch.Ref.S.74;][ChemischesZentralblatt,1932,vol.103,#II,p.2449]

[3]Hahn;Stiehl[ChemischeBerichte,1938,vol.71,p.2154,2161]

[4]Hoveyda,HamidR.;Marsault,Eric;Gagnon,René;Mathieu,AxelP.;Vézina,Martin;Landry,Annick;Wang,Zhigang;Benakli,Kamel;Beaubien,Sylvie;Saint-Louis,Carl;Brassard,Martin;Pinault,Jean-François;Ouellet,Luc;Bhat,Shridhar;Ramaseshan,Mahesh;Peng,Xiaowen;Foucher,Laurence;Beauchemin,Sophie;Bhérer,Patrick;Veber,DanielF.;Peterson,MarkL.;Fraser,GraemeL.[JournalofMedicinalChemistry,2011,vol.54,#24,p.8305-8320]

[5]Budeev,AntonV.;Kantin,Grigory;Dar'In,Dmitry;Krasavin,Mikhail[Synthesis,2021,vol.53,#12,p.2155-2166]

[1]Patent:DE233551,    Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.10,p.1231

1,3-bis(2-hydroxyphenethyl)urea 
  2039-66-9 

[1]Pschorr;Einbeck[ChemischeBerichte,1905,vol.38,p.2069]

[1]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-DE1959898,1970,A1[Chem.Abstr.,1970,vol.73,#45092][Chem.Abstr.,1970,vol.73,#45092]

[1]CurrentPatentAssignee:IVOTEC;VIFORPHARMALTD-US2012/202806,2012,A1

[2]Epstein,J.etal.[JournaloftheAmericanChemicalSociety,1964,vol.86,p.3075-3084]

[3]Lewin,AnitaH.;Navarro,HernanA.;WayneMascarella[BioorganicandMedicinalChemistry,2008,vol.16,#15,p.7415-7423]

[4]Ke,Shaoyong;Zhang,Zhigang;Shi,Liqiao;Liu,Manli;Fang,Wei;Zhang,Yani;Wu,Zhaoyuan;Wan,Zhongyi;Long,Tong;Wang,Kaimei[OrganicandBiomolecularChemistry,2019,vol.17,#14,p.3635-3639]

[5]Cao,Zhaozhen;Gong,Yanjun;Liu,Rongjuan;Wei,Jingjing;Yang,Zhijie;Zhang,Fenghua;Zhang,Zongze[AngewandteChemie-InternationalEdition,2022,vol.61,#10][Angew.Chem.,2022,vol.134,#10]

Literature

Title: Structure-activity correlations for beta-phenethylamines at human trace amine receptor 1.

Journal: Bioorganic & medicinal chemistry 20080801

Title: Enzymic formation of ortho-tyramine (o-hydroxyphenylethylamine).

Journal: The Journal of physiology 19491231

Quotation Request
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SDS
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Tags:2039-66-9 Molecular Formula|2039-66-9 MDL|2039-66-9 SMILES|2039-66-9 2-(2-Aminoethyl)phenol
Catalog No.: AA00293O
2039-66-9,MFCD00192585
2039-66-9 | 2-(2-Aminoethyl)phenol
Pack Size： 1g
Purity： 95%
in stock
$69.00 $48.00
Pack Size： 5g
Purity： 95%
in stock
$321.00 $225.00
Pack Size： 10g
Purity： 95%
in stock
$640.00 $448.00
Pack Size： 25g
Purity： 98%
in stock
$1,345.00 $942.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00293O
Chemical Name: 2-(2-Aminoethyl)phenol
CAS Number: 2039-66-9
Molecular Formula: C8H11NO
Molecular Weight: 137.1790
MDL Number: MFCD00192585
SMILES: NCCc1ccccc1O
Properties
BP: 258°C at 760 mmHg  
Form: Solid  
Storage: Inert atmosphere;2-8℃;  
Complexity: 95.3  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1  
Downstream Synthesis Route
3156-43-2    2039-66-9 

[1]Locationinpatent:experimentalpartHellal,Malik;Singh,Shambhavi;Cuny,GregoryD.[Tetrahedron,2012,vol.68,#6,p.1674-1681]

[2]Kondo;Tanaka[YakugakuZasshi/JournalofthePharmaceuticalSocietyofJapan,1932,vol.52,p.608,610;dtsch.Ref.S.74;][ChemischesZentralblatt,1932,vol.103,#II,p.2449]

[3]Hahn;Stiehl[ChemischeBerichte,1938,vol.71,p.2154,2161]

[4]Hoveyda,HamidR.;Marsault,Eric;Gagnon,René;Mathieu,AxelP.;Vézina,Martin;Landry,Annick;Wang,Zhigang;Benakli,Kamel;Beaubien,Sylvie;Saint-Louis,Carl;Brassard,Martin;Pinault,Jean-François;Ouellet,Luc;Bhat,Shridhar;Ramaseshan,Mahesh;Peng,Xiaowen;Foucher,Laurence;Beauchemin,Sophie;Bhérer,Patrick;Veber,DanielF.;Peterson,MarkL.;Fraser,GraemeL.[JournalofMedicinalChemistry,2011,vol.54,#24,p.8305-8320]

[5]Budeev,AntonV.;Kantin,Grigory;Dar'In,Dmitry;Krasavin,Mikhail[Synthesis,2021,vol.53,#12,p.2155-2166]

22367-76-6    2039-66-9 

[1]Patent:DE233551,    Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.10,p.1231

1,3-bis(2-hydroxyphenethyl)urea 
  2039-66-9 

[1]Pschorr;Einbeck[ChemischeBerichte,1905,vol.38,p.2069]

2039-66-9    67-64-1    46191-88-2 

[1]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-DE1959898,1970,A1[Chem.Abstr.,1970,vol.73,#45092][Chem.Abstr.,1970,vol.73,#45092]

2045-79-6    2039-66-9 

[1]CurrentPatentAssignee:IVOTEC;VIFORPHARMALTD-US2012/202806,2012,A1

[2]Epstein,J.etal.[JournaloftheAmericanChemicalSociety,1964,vol.86,p.3075-3084]

[3]Lewin,AnitaH.;Navarro,HernanA.;WayneMascarella[BioorganicandMedicinalChemistry,2008,vol.16,#15,p.7415-7423]

[4]Ke,Shaoyong;Zhang,Zhigang;Shi,Liqiao;Liu,Manli;Fang,Wei;Zhang,Yani;Wu,Zhaoyuan;Wan,Zhongyi;Long,Tong;Wang,Kaimei[OrganicandBiomolecularChemistry,2019,vol.17,#14,p.3635-3639]

[5]Cao,Zhaozhen;Gong,Yanjun;Liu,Rongjuan;Wei,Jingjing;Yang,Zhijie;Zhang,Fenghua;Zhang,Zongze[AngewandteChemie-InternationalEdition,2022,vol.61,#10][Angew.Chem.,2022,vol.134,#10]

Literature fold

Title: Structure-activity correlations for beta-phenethylamines at human trace amine receptor 1.

Journal: Bioorganic & medicinal chemistry20080801

Title: Enzymic formation of ortho-tyramine (o-hydroxyphenylethylamine).

Journal: The Journal of physiology19491231

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