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Home Other Building Blocks 1077-58-3
1077-58-3,MFCD09258829
Catalog No.:AA007DR9

1077-58-3 | 2-tert-Butylbenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$38.00   $27.00
- +
250mg
95%
in stock  
$46.00   $32.00
- +
1g
98%
in stock  
$160.00   $112.00
- +
5g
98%
in stock  
$439.00   $307.00
- +
25g
98%
in stock  
$2,148.00   $1,504.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA007DR9
Chemical Name:
2-tert-Butylbenzoic acid
CAS Number:
1077-58-3
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
MDL Number:
MFCD09258829
SMILES:
OC(=O)c1ccccc1C(C)(C)C
NSC Number:
86592
Properties
Computed Properties
 
Complexity:
191  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
3.8  

Downstream Synthesis Route

[1]JournaloftheChemicalSociety,1952,p.4443,4445

[2]Molecules,2019,vol.24

1077-58-3   
2-ethyl-4,6-dimethyl-3,5-dinitro-benzoicacid 

[1]ChemischeBerichte,1899,vol.32,p.1127

[1]RecueildesTravauxChimiquesdesPays-Bas,1960,vol.79,p.1211-1222

[1]RecueildesTravauxChimiquesdesPays-Bas,1960,vol.79,p.1211-1222

[1]RecueildesTravauxChimiquesdesPays-Bas,1967,vol.86,p.69-79

Literature
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Additional Info:
SDS
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Tags:1077-58-3 Molecular Formula|1077-58-3 MDL|1077-58-3 SMILES|1077-58-3 2-tert-Butylbenzoic acid