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Home Bromides 5333-13-1
5333-13-1,MFCD24107207
Catalog No.:AA01B6N4

5333-13-1 | 3-bromo-2,4,6-trimethylbenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
1 week  
$321.00   $225.00
- +
500mg
95%
1 week  
$434.00   $304.00
- +
1g
95%
1 week  
$585.00   $409.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA01B6N4
Chemical Name:
3-bromo-2,4,6-trimethylbenzoic acid
CAS Number:
5333-13-1
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.0971
MDL Number:
MFCD24107207
SMILES:
OC(=O)c1c(C)cc(c(c1C)Br)C
NSC Number:
601
Properties
Computed Properties
 
Complexity:
205  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
3.2  

Downstream Synthesis Route

[1]ChemischeBerichte,1987,vol.120,p.803-810

[2]SyntheticCommunications,2014,vol.44,p.181-187

[3]JournaloftheAmericanChemicalSociety,1953,vol.75,p.3319,3320

[4]JournaloftheAmericanChemicalSociety,1942,vol.64,p.2888,2890

[5]Patent:CN109180483,2019,A.Locationinpatent:Paragraph0031-0037

[1]Hart,H.;Janssen,J.F.[JournalofOrganicChemistry,1970,vol.35,p.3637-3641]

[1]CurrentPatentAssignee:SHANGHAIBCCHEMICTECH-CN109180483,2019,ALocationinpatent:Paragraph0038-0043

Literature
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SDS
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Tags:5333-13-1 Molecular Formula|5333-13-1 MDL|5333-13-1 SMILES|5333-13-1 3-bromo-2,4,6-trimethylbenzoic acid