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34649-21-3,MFCD01348229
Catalog No.:AA00C8MR

34649-21-3 | 4,5-Dibromo-1h-pyrrole-2-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
96%
in stock  
$112.00   $78.00
- +
1g
96%
in stock  
$253.00   $177.00
- +
5g
96%
in stock  
$1,075.00 $753.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00C8MR
Chemical Name:
4,5-Dibromo-1h-pyrrole-2-carboxylic acid
CAS Number:
34649-21-3
Molecular Formula:
C5H3Br2NO2
Molecular Weight:
268.8908
MDL Number:
MFCD01348229
SMILES:
Brc1[nH]c(cc1Br)C(=O)O
NSC Number:
320005
Properties
Properties
 
BP:
441.5°C at 760 mmHg  
Form:
Solid  
MP:
>300°C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
153  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
2.3  

Downstream Synthesis Route

[1]Ponasik,JamesA.;Kassab,DarrenJ.;Ganem,Bruce[TetrahedronLetters,1996,vol.37,#34,p.6041-6044]

[2]Ponasik,JamesA.;Conova,Susan;Kinghorn,Denise;Kinney,WilliamA.;Rittschof,Daniel;Ganem,Bruce[Tetrahedron,1998,vol.54,#25,p.6977-6986]

[3]CurrentPatentAssignee:UNIVERSITYOFNORTHCAROLINASYSTEM-US2008/181923,2008,A1Locationinpatent:Page/Pagecolumn35;40

[4]CurrentPatentAssignee:UNIVERSITYOFNORTHCAROLINASYSTEM-US2009/143230,2009,A1Locationinpatent:Page/Pagecolumn46-47

[5]Locationinpatent:experimentalpartWang,Ming-Zhong;Xu,Han;Liu,Tuan-Wei;Feng,Qi;Yu,Shu-Jing;Wang,Su-Hua;Li,Zheng-Ming[EuropeanJournalofMedicinalChemistry,2011,vol.46,#5,p.1463-1472]

[1]CurrentPatentAssignee:BAYERAG-US3963480,1976,A

[2]CurrentPatentAssignee:BAYERAG-US4046775,1977,A

59954-04-0    34649-21-3   
methyl2-(4-(4,5-dibromo-1H-pyrrole-2-carboxamido)phenoxy)acetate 

[1]Zidar,Nace;Macut,Helena;Tomašič,Tihomir;Brvar,Matjaž;Montalvão,Sofia;Tammela,Päivi;Solmajer,Tom;PeterlinMašič,Lucija;Ilaš,Janez;Kikelj,Danijel[JournalofMedicinalChemistry,2015,vol.58,#15,p.6179-6194]

[2]Zidar,Nace;Macut,Helena;Tomašič,Tihomir;PeterlinMašič,Lucija;Ilaš,Janez;Zega,Anamarija;Tammela,Päivi;Kikelj,Danijel[MedChemComm,2019,vol.10,#6,p.1007-1017]

52481-41-1    34649-21-3   
4,5-dibromo-N-(4-(2-morpholinoethoxy)phenyl)-1H-pyrrole-2-carboxamide 

[1]JournalofMedicinalChemistry,2015,vol.58,p.6179-6194

62456-15-9    34649-21-3   
C13H16Br2N2O3 

[1]EuropeanJournalofMedicinalChemistry,2017,vol.125,p.500-514

Literature

Title: Bromopyrrole alkaloids as lead compounds against protozoan parasites.

Journal: Marine drugs 20100101

Title: A submarine journey: the pyrrole-imidazole alkaloids.

Journal: Marine drugs 20091201

Title: Marine natural products from the Turkish sponge Agelas oroides that inhibit the enoyl reductases from Plasmodium falciparum, Mycobacterium tuberculosis and Escherichia coli.

Journal: Bioorganic & medicinal chemistry 20071101

Title: A secondary metabolite, 4,5-dibromopyrrole-2-carboxylic acid, from marine sponges of the genus Agelas alters cellular calcium signals.

Journal: Environmental toxicology and pharmacology 20050501

Title: Brominated pyrrole alkaloids from marine Agelas sponges reduce depolarization-induced cellular calcium elevation.

Journal: Toxicon : official journal of the International Society on Toxinology 20040701

Title: Sventrin, a new bromopyrrole alkaloid from the Caribbean sponge Agelas sventres.

Journal: Journal of natural products 20011201

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SDS
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Tags:34649-21-3 Molecular Formula|34649-21-3 MDL|34649-21-3 SMILES|34649-21-3 4,5-Dibromo-1h-pyrrole-2-carboxylic acid
Catalog No.: AA00C8MR
34649-21-3,MFCD01348229
34649-21-3 | 4,5-Dibromo-1h-pyrrole-2-carboxylic acid
Pack Size： 250mg
Purity： 96%
in stock
$112.00 $78.00
Pack Size： 1g
Purity： 96%
in stock
$253.00 $177.00
Pack Size： 5g
Purity： 96%
in stock
$1,075.00 $753.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA00C8MR
Chemical Name: 4,5-Dibromo-1h-pyrrole-2-carboxylic acid
CAS Number: 34649-21-3
Molecular Formula: C5H3Br2NO2
Molecular Weight: 268.8908
MDL Number: MFCD01348229
SMILES: Brc1[nH]c(cc1Br)C(=O)O
NSC Number: 320005
Properties
BP: 441.5°C at 760 mmHg  
Form: Solid  
MP: >300°C  
Storage: Keep in dry area;2-8℃;  
Complexity: 153  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 2  
Rotatable Bond Count: 1  
XLogP3: 2.3  
Downstream Synthesis Route
634-97-9    34649-21-3 

[1]Ponasik,JamesA.;Kassab,DarrenJ.;Ganem,Bruce[TetrahedronLetters,1996,vol.37,#34,p.6041-6044]

[2]Ponasik,JamesA.;Conova,Susan;Kinghorn,Denise;Kinney,WilliamA.;Rittschof,Daniel;Ganem,Bruce[Tetrahedron,1998,vol.54,#25,p.6977-6986]

[3]CurrentPatentAssignee:UNIVERSITYOFNORTHCAROLINASYSTEM-US2008/181923,2008,A1Locationinpatent:Page/Pagecolumn35;40

[4]CurrentPatentAssignee:UNIVERSITYOFNORTHCAROLINASYSTEM-US2009/143230,2009,A1Locationinpatent:Page/Pagecolumn46-47

[5]Locationinpatent:experimentalpartWang,Ming-Zhong;Xu,Han;Liu,Tuan-Wei;Feng,Qi;Yu,Shu-Jing;Wang,Su-Hua;Li,Zheng-Ming[EuropeanJournalofMedicinalChemistry,2011,vol.46,#5,p.1463-1472]

626-40-4    34649-21-3    50371-39-6 

[1]CurrentPatentAssignee:BAYERAG-US3963480,1976,A

[2]CurrentPatentAssignee:BAYERAG-US4046775,1977,A

59954-04-0    34649-21-3   
methyl2-(4-(4,5-dibromo-1H-pyrrole-2-carboxamido)phenoxy)acetate 

[1]Zidar,Nace;Macut,Helena;Tomašič,Tihomir;Brvar,Matjaž;Montalvão,Sofia;Tammela,Päivi;Solmajer,Tom;PeterlinMašič,Lucija;Ilaš,Janez;Kikelj,Danijel[JournalofMedicinalChemistry,2015,vol.58,#15,p.6179-6194]

[2]Zidar,Nace;Macut,Helena;Tomašič,Tihomir;PeterlinMašič,Lucija;Ilaš,Janez;Zega,Anamarija;Tammela,Päivi;Kikelj,Danijel[MedChemComm,2019,vol.10,#6,p.1007-1017]

52481-41-1    34649-21-3   
4,5-dibromo-N-(4-(2-morpholinoethoxy)phenyl)-1H-pyrrole-2-carboxamide 

[1]JournalofMedicinalChemistry,2015,vol.58,p.6179-6194

62456-15-9    34649-21-3   
C13H16Br2N2O3 

[1]EuropeanJournalofMedicinalChemistry,2017,vol.125,p.500-514

Literature fold

Title: Bromopyrrole alkaloids as lead compounds against protozoan parasites.

Journal: Marine drugs20100101

Title: A submarine journey: the pyrrole-imidazole alkaloids.

Journal: Marine drugs20091201

Title: Marine natural products from the Turkish sponge Agelas oroides that inhibit the enoyl reductases from Plasmodium falciparum, Mycobacterium tuberculosis and Escherichia coli.

Journal: Bioorganic & medicinal chemistry20071101

Title: A secondary metabolite, 4,5-dibromopyrrole-2-carboxylic acid, from marine sponges of the genus Agelas alters cellular calcium signals.

Journal: Environmental toxicology and pharmacology20050501

Title: Brominated pyrrole alkaloids from marine Agelas sponges reduce depolarization-induced cellular calcium elevation.

Journal: Toxicon : official journal of the International Society on Toxinology20040701

Title: Sventrin, a new bromopyrrole alkaloid from the Caribbean sponge Agelas sventres.

Journal: Journal of natural products20011201

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