Home Bromides 54367-67-8
54367-67-8,MFCD22052492
Catalog No.:AA00DL7L

54367-67-8 | 5-Bromo-1-methyl-1H-pyrazole-4-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$12.00   $8.00
- +
250mg
97%
in stock  
$14.00   $10.00
- +
1g
97%
in stock  
$31.00   $22.00
- +
5g
97%
in stock  
$105.00   $74.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DL7L
Chemical Name:
5-Bromo-1-methyl-1H-pyrazole-4-carboxylic acid
CAS Number:
54367-67-8
Molecular Formula:
C5H5BrN2O2
Molecular Weight:
205.0094
MDL Number:
MFCD22052492
SMILES:
OC(=O)c1cnn(c1Br)C
Properties
Computed Properties
 
Complexity:
153  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
0.8  

Downstream Synthesis Route
54367-67-8   
decahydroquinoline 
  911645-21-1 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2006/223852,2006,A1Locationinpatent:Page/Pagecolumn10

[1]Patent:US2012/214791,2012,A1.Locationinpatent:Page/Pagecolumn23

[2]JournalofMedicinalChemistry,2018,vol.61,p.1001-1018

[3]Patent:WO2018/64119,2018,A1.Locationinpatent:Paragraph0939

[4]Patent:US2006/223852,2006,A1.Locationinpatent:Page/Pagecolumn10

[1]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-WO2010/64722,2010,A1Locationinpatent:Page/Pagecolumn146-147

[1]CurrentPatentAssignee:KIMBERLY-CLARKCORP;PFIZERINC-US2012/214791,2012,A1

[2]Helal,ChristopherJ.;Arnold,Eric;Boyden,Tracey;Chang,Cheng;Chappie,ThomasA.;Fisher,Ethan;Hajos,Mihaly;Harms,JohnF.;Hoffman,WilliamE.;Humphrey,JohnM.;Pandit,Jayvardhan;Kang,Zhijun;Kleiman,RobinJ.;Kormos,BethanyL.;Lee,Che-Wah;Lu,Jiemin;Maklad,Noha;McDowell,Laura;McGinnis,Dina;O'Connor,RebeccaE.;O'Donnell,ChristopherJ.;Ogden,Adam;Piotrowski,Mary;Schmidt,ChristopherJ.;Seymour,PatriciaA.;Ueno,Hirokazu;Vansell,Nichole;Verhoest,PatrickR.;Yang,EdwardX.[JournalofMedicinalChemistry,2018,vol.61,#3,p.1001-1018]

Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Country:
Additional Info:
SDS
Tags:54367-67-8 Molecular Formula|54367-67-8 MDL|54367-67-8 SMILES|54367-67-8 5-Bromo-1-methyl-1H-pyrazole-4-carboxylic acid