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98021-61-5,MFCD10694017
Catalog No.:AA01FFS6

98021-61-5 | 2-(prop-2-yn-1-yloxy)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$231.00   $162.00
- +
1g
95%
in stock  
$297.00   $208.00
- +
5g
95%
in stock  
$1,004.00   $703.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01FFS6
Chemical Name:
2-(prop-2-yn-1-yloxy)acetic acid
CAS Number:
98021-61-5
Molecular Formula:
C5H6O3
Molecular Weight:
114.0993
MDL Number:
MFCD10694017
SMILES:
C#CCOCC(=O)O
Properties
Computed Properties
 
Complexity:
119  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
-0.2  

Downstream Synthesis Route

[1]Yamamoto,Makoto;Dewa,Toshikazu;Munakata,Hiroshi;Kohmoto,Shigeo;Yamada,Kazutoshi[JournalofChemicalResearch,Miniprint,1991,#7,p.1771-1782]

[1]Yamamoto,Makoto;Dewa,Toshikazu;Munakata,Hiroshi;Kohmoto,Shigeo;Yamada,Kazutoshi[JournalofChemicalResearch,Miniprint,1991,#7,p.1771-1782]

[2]Zhang,Xu;Zhou,Yu;Wang,Hengshuai;Guo,Diliang;Ye,Deju;Xu,Yungen;Jiang,Hualiang;Liu,Hong[GreenChemistry,2011,vol.13,#2,p.397-405]

[3]Zhang,Xu;Zhou,Yu;Wang,Hengshuai;Guo,Diliang;Ye,Deju;Xu,Yungen;Jiang,Hualiang;Liu,Hong[AdvancedSynthesisandCatalysis,2011,vol.353,#9,p.1429-1437]

[1]Gilchrist,ThomasL.;Wasson,RobertC.;King,FrankD.;Wootton,Gordon[JournaloftheChemicalSociety.PerkintransactionsI,1987,p.2517-2522]

[2]PinhoMelo,TeresaM.V.;Barbosa,DaliaM.;Ramos,PauloJ.R.S.;RochaGonsalves,AntonioM.;Gilchrist,ThomasL.;Beja,AnaM.;Paixaeo,JoseA.;Silva,ManuelaR.;Veiga,LuizAlteDa[JournaloftheChemicalSociety.PerkintransactionsI,1999,#9,p.1219-1223]

[1]PinhoMelo,TeresaM.V.;Barbosa,DaliaM.;Ramos,PauloJ.R.S.;RochaGonsalves,AntonioM.;Gilchrist,ThomasL.;Beja,AnaM.;Paixaeo,JoseA.;Silva,ManuelaR.;Veiga,LuizAlteDa[JournaloftheChemicalSociety.PerkintransactionsI,1999,#9,p.1219-1223]

[2]PinhoeMelo,TeresaM.V.D.;Soares,MariaI.L.;RochaGonsalves,AntonioM.d'A.;Paixao,JoseA.;Beja,AnaM.;RamosSilva,Manuela;AltedaVeiga,Luiz;CostaPessoa,Joao[JournalofOrganicChemistry,2002,vol.67,#12,p.4045-4054]

[3]Wurz,RyanP.;Dellamaggiore,Ken;Dou,Hannah;Javier,Noelle;Lo,Mei-Chu;McCarter,JohnD.;Mohl,Dane;Sastri,Christine;Lipford,J.Russell;Cee,VictorJ.[JournalofMedicinalChemistry,2018,vol.61,#2,p.453-461]

29709-35-1    98021-61-5   
C11H14N2O2 

[1]Yang,Ting;Campbell,Leonie;Dixon,DarrenJ.[JournaloftheAmericanChemicalSociety,2007,vol.129,#40,p.12070-12071]

Literature
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SDS
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Tags:98021-61-5 Molecular Formula|98021-61-5 MDL|98021-61-5 SMILES|98021-61-5 2-(prop-2-yn-1-yloxy)acetic acid
Catalog No.: AA01FFS6
98021-61-5,MFCD10694017
98021-61-5 | 2-(prop-2-yn-1-yloxy)acetic acid
Pack Size： 250mg
Purity： 95%
in stock
$231.00 $162.00
Pack Size： 1g
Purity： 95%
in stock
$297.00 $208.00
Pack Size： 5g
Purity： 95%
in stock
$1,004.00 $703.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA01FFS6
Chemical Name: 2-(prop-2-yn-1-yloxy)acetic acid
CAS Number: 98021-61-5
Molecular Formula: C5H6O3
Molecular Weight: 114.0993
MDL Number: MFCD10694017
SMILES: C#CCOCC(=O)O
Properties
Complexity: 119  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 8  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: -0.2  
Downstream Synthesis Route
98021-61-5    135450-14-5 

[1]Yamamoto,Makoto;Dewa,Toshikazu;Munakata,Hiroshi;Kohmoto,Shigeo;Yamada,Kazutoshi[JournalofChemicalResearch,Miniprint,1991,#7,p.1771-1782]

77353-35-6    98021-61-5 

[1]Yamamoto,Makoto;Dewa,Toshikazu;Munakata,Hiroshi;Kohmoto,Shigeo;Yamada,Kazutoshi[JournalofChemicalResearch,Miniprint,1991,#7,p.1771-1782]

[2]Zhang,Xu;Zhou,Yu;Wang,Hengshuai;Guo,Diliang;Ye,Deju;Xu,Yungen;Jiang,Hualiang;Liu,Hong[GreenChemistry,2011,vol.13,#2,p.397-405]

[3]Zhang,Xu;Zhou,Yu;Wang,Hengshuai;Guo,Diliang;Ye,Deju;Xu,Yungen;Jiang,Hualiang;Liu,Hong[AdvancedSynthesisandCatalysis,2011,vol.353,#9,p.1429-1437]

107-19-7    79-11-8    98021-61-5 

[1]Gilchrist,ThomasL.;Wasson,RobertC.;King,FrankD.;Wootton,Gordon[JournaloftheChemicalSociety.PerkintransactionsI,1987,p.2517-2522]

[2]PinhoMelo,TeresaM.V.;Barbosa,DaliaM.;Ramos,PauloJ.R.S.;RochaGonsalves,AntonioM.;Gilchrist,ThomasL.;Beja,AnaM.;Paixaeo,JoseA.;Silva,ManuelaR.;Veiga,LuizAlteDa[JournaloftheChemicalSociety.PerkintransactionsI,1999,#9,p.1219-1223]

98021-61-5    77378-24-6 

[1]PinhoMelo,TeresaM.V.;Barbosa,DaliaM.;Ramos,PauloJ.R.S.;RochaGonsalves,AntonioM.;Gilchrist,ThomasL.;Beja,AnaM.;Paixaeo,JoseA.;Silva,ManuelaR.;Veiga,LuizAlteDa[JournaloftheChemicalSociety.PerkintransactionsI,1999,#9,p.1219-1223]

[2]PinhoeMelo,TeresaM.V.D.;Soares,MariaI.L.;RochaGonsalves,AntonioM.d'A.;Paixao,JoseA.;Beja,AnaM.;RamosSilva,Manuela;AltedaVeiga,Luiz;CostaPessoa,Joao[JournalofOrganicChemistry,2002,vol.67,#12,p.4045-4054]

[3]Wurz,RyanP.;Dellamaggiore,Ken;Dou,Hannah;Javier,Noelle;Lo,Mei-Chu;McCarter,JohnD.;Mohl,Dane;Sastri,Christine;Lipford,J.Russell;Cee,VictorJ.[JournalofMedicinalChemistry,2018,vol.61,#2,p.453-461]

29709-35-1    98021-61-5   
C11H14N2O2 

[1]Yang,Ting;Campbell,Leonie;Dixon,DarrenJ.[JournaloftheAmericanChemicalSociety,2007,vol.129,#40,p.12070-12071]

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Historical Records
1000517-01-0
1000517-01-0
883544-58-9
883544-58-9
1448053-46-0
1448053-46-0
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