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4144-64-3,MFCD00553342
Catalog No.:AA00BYGH

4144-64-3 | Benzotriazol-1-yl-acetic acid

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Price(USD)
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250mg
96%
in stock  
$8.00   $6.00
- +
1g
96%
in stock  
$15.00   $11.00
- +
5g
96%
in stock  
$56.00   $39.00
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25g
96%
in stock  
$260.00   $182.00
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100g
96%
in stock  
$976.00   $683.00
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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:
AA00BYGH
Chemical Name:
Benzotriazol-1-yl-acetic acid
CAS Number:
4144-64-3
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
MDL Number:
MFCD00553342
SMILES:
OC(=O)Cn1nnc2c1cccc2
NSC Number:
227393
Properties
Properties
 
BP:
427.2°C at 760 mmHg  
Form:
Solid  
MP:
216-219°C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
210  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.6  

Downstream Synthesis Route

[1]LiebigsAnnalenderChemie,1994,p.1-6

4144-64-3    33513-42-7   
2-(1-benzotriazolyl)-1,1,5,5-tetramethyl-1,5-diazapentadieniumhexafluorophosphate 

[1]Gupton,JohnT.;Hicks,FredA.;Smith,StantonQ.;Main,A.Denise;Petrich,ScottA.;etal.[Tetrahedron,1993,vol.49,#45,p.10205-10218]

[1]Gupton,JohnT.;Hicks,FredA.;Smith,StantonQ.;Main,A.Denise;Petrich,ScottA.;etal.[Tetrahedron,1993,vol.49,#45,p.10205-10218]

[2]Teixeira,FátimaC.;DeSá,AnaI.;Teixeira,AntónioP.S.;Rangel[NewJournalofChemistry,2019,vol.43,#38,p.15249-15257]

[3]Duan,Jiaokui;Ma,Ben;Wang,Ganggang;Wu,Chengqi;Xiao,Jianliang;Yang,Jingya;Zhou,Hongyan[OrganicLetters,2020,vol.22,#18,p.7284-7289]

[1]Katritzky,AlanR.;Aslan,Diana;Shcherbakova,IrinaV.;Chen,Jie;Belyakov,SergeiA.[JournalofHeterocyclicChemistry,1996,vol.33,#4,p.1107-1114]

[2]Sharma;Saluja;Bhaduri[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2000,vol.39,#2,p.156-159]

[3]Locationinpatent:experimentalpartChen,Xiqing;Liu,Chenjiang;Wang,Jide;Li,Yanping[JournalofHeterocyclicChemistry,2010,vol.47,#5,p.1225-1229]

[4]Shukla,YogendraK.;Srivastava,SavitriD.[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1994,vol.33,#4,p.397-399]

[5]Halwe,Kirti;Srivastava,S.K.[JournaloftheIndianChemicalSociety,1995,vol.72,#1,p.59-62]

[6]Yu,Tianzhi;Zhao,Yuling;Fan,Duowang[JournalofMolecularStructure,2006,vol.791,#1-3,p.18-22]

[7]St.John,SarahE.;Tomar,Sakshi;Stauffer,ShaunR.;Mesecar,AndrewD.[BioorganicandMedicinalChemistry,2015,vol.23,#17,p.6036-6048]

[8]Jain,Jyoti;Srivastava,SantoshK.[JournaloftheIndianChemicalSociety,1994,vol.71,#11,p.691-692]

[9]Locationinpatent:experimentalpartYu,Tianzhi;Zhang,Peng;Zhao,Yuling;Zhang,Hui;Fan,Duowang;Dong,Wenkui;Ding,Lan[Phosphorus,SulfurandSiliconandtheRelatedElements,2009,vol.184,#10,p.2655-2663]

[10]Jahed,FatemehSoghra;Galehassadi,Mohammad;Davaran,Soodabeh[JournalofChemicalSciences,2019,vol.131,#3]

[11]CurrentPatentAssignee:EASTCHINAJIAOTONGUNIVERSITY-CN104327054,2019,BLocationinpatent:Paragraph0009;0020-0022

[1]Halwe,Kirti;Srivastava,S.K.[JournaloftheIndianChemicalSociety,1995,vol.72,#1,p.59-62]

[2]Shukla,YogendraK.;Srivastava,SavitriD.[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1994,vol.33,#4,p.397-399]

[3]Jain,Jyoti;Srivastava,SantoshK.[JournaloftheIndianChemicalSociety,1994,vol.71,#11,p.691-692]

[4]CurrentPatentAssignee:DOMPE'FARMACEUTICI-S.P.A.-US2014/371274,2014,A1Locationinpatent:Paragraph0140

Literature

Title: (Acetato-κO)diaqua-[2-(1H-benzotriazol-1-yl)acetato-κO](1,10-phenanthroline-κN,N')manganese(II) dihydrate.

Journal: Acta crystallographica. Section E, Structure reports online 20120301

Title: Ethyl 2-(1H-1,2,3-benzotriazol-1-yl)acetate.

Journal: Acta crystallographica. Section E, Structure reports online 20110101

Title: 2-(1H-Benzotriazol-1-yl)acetohydrazide.

Journal: Acta crystallographica. Section E, Structure reports online 20090701

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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