Home Bromides 855198-27-5
855198-27-5,MFCD17015802
Catalog No.:AA008HI0

855198-27-5 | 3-Bromo-5-ethoxybenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$211.00   $148.00
- +
5g
98%
in stock  
$610.00   $427.00
- +
10g
98%
in stock  
$1,009.00   $706.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA008HI0
Chemical Name:
3-Bromo-5-ethoxybenzoic acid
CAS Number:
855198-27-5
Molecular Formula:
C9H9BrO3
Molecular Weight:
245.0700
MDL Number:
MFCD17015802
SMILES:
CCOc1cc(Br)cc(c1)C(=O)O
Properties
Computed Properties
 
Complexity:
184  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.5  

Downstream Synthesis Route

[1]Baddaretal.[JournaloftheChemicalSociety,1955,p.461,464][JournaloftheChemicalSociety,1959,p.1027,1030]

ethyl-(5-iodo-2naphthyl)-ether 
  855198-27-5   
5,5'-diethoxy-biphenyl-3,3'-dicarboxylicacid 

[1]Baddaretal.[JournaloftheChemicalSociety,1955,p.461,464][JournaloftheChemicalSociety,1959,p.1027,1030]

[1]Hewings,DavidS.;Wang,Minghua;Philpott,Martin;Fedorov,Oleg;Uttarkar,Sagar;Filippakopoulos,Panagis;Picaud,Sarah;Vuppusetty,Chaitanya;Marsden,Brian;Knapp,Stefan;Conway,StuartJ.;Heightman,TomD.[JournalofMedicinalChemistry,2011,vol.54,#19,p.6761-6770]

[2]CurrentPatentAssignee:ROCHEHOLDINGAG;SIENABIOTECHS.P.A.SOCIETA'INLIQUIDAZIONE-US2009/209529,2009,A1Locationinpatent:Page/Pagecolumn40

[1]CurrentPatentAssignee:ROCHEHOLDINGAG;SIENABIOTECHS.P.A.SOCIETA'INLIQUIDAZIONE-US2009/209529,2009,A1Locationinpatent:Page/Pagecolumn40

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2017/6295,2017,A1Locationinpatent:Page/Pagecolumn116;122

[2]Hewings,DavidS.;Wang,Minghua;Philpott,Martin;Fedorov,Oleg;Uttarkar,Sagar;Filippakopoulos,Panagis;Picaud,Sarah;Vuppusetty,Chaitanya;Marsden,Brian;Knapp,Stefan;Conway,StuartJ.;Heightman,TomD.[JournalofMedicinalChemistry,2011,vol.54,#19,p.6761-6770]

Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Country:
Additional Info:
SDS
Tags:855198-27-5 Molecular Formula|855198-27-5 MDL|855198-27-5 SMILES|855198-27-5 3-Bromo-5-ethoxybenzoic acid