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Home Amines 68176-57-8
68176-57-8,MFCD00052695
Catalog No.:AA003K7U

68176-57-8 | 4-(tert-Butyl)-1,2-diaminobenzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$11.00   $8.00
- +
1g
97%
in stock  
$18.00   $13.00
- +
5g
97%
in stock  
$43.00   $30.00
- +
10g
97%
in stock  
$65.00   $46.00
- +
25g
97%
in stock  
$143.00   $100.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003K7U
Chemical Name:
4-(tert-Butyl)-1,2-diaminobenzene
CAS Number:
68176-57-8
Molecular Formula:
C10H16N2
Molecular Weight:
164.2474
MDL Number:
MFCD00052695
SMILES:
Nc1ccc(cc1N)C(C)(C)C
Properties
Properties
 
BP:
290.5°C at 760 mmHg  
Form:
Solid  
MP:
98 °C  
Solubility:
Soluble in most common organic solvents.  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
148  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
1.9  

Upstream Synthesis Route

[1]ChemischeBerichte,1887,vol.20,p.3257

[2]ChemischeBerichte,1888,vol.21,p.2952

[3]JournalofMedicinalChemistry,1995,vol.38,#25,p.4906-4916

[1]JournalofMedicinalChemistry,1995,vol.38,#25,p.4906-4916

[1]JournalofMedicinalChemistry,1995,vol.38,#25,p.4906-4916

[1]JournalofMedicinalChemistry,1995,vol.38,#25,p.4906-4916

[1]JournalofMedicinalChemistry,1995,vol.38,#25,p.4906-4916

Downstream Synthesis Route
2-ethoxycarbonyl-3-bromo-7-tert-butoxycarbonyl-7-azabicyclo2.2.1heptane-2,5-diene 
  68176-57-8   
cis-5-(5-tert-butyl-1H-benzimidazol-2-yl)-2-(ethoxycarbonylmethyl)-2,5-dihydropyrrole-1-carboxylicacidtert-butylester 

[1]Synthesis,2005,p.2357-2366

98-98-6    68176-57-8   
5-<i>tert</i>-butyl-2-pyridin-2-yl-1<i>H</i>-benzoimidazole 

[1]JournalofMedicinalChemistry,2006,vol.49,p.511-522

919088-10-1    68176-57-8   
5-tert-butyl-2-{3-chloro-4-3-(4-methyl-piperazin-1-yl)-propoxy-phenyl}-1H-benzoimidazole 

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.6043-6048

848847-23-4    68176-57-8   
5-tert-butyl-2-{2-chloro-4-3-(4-methyl-piperazin-1-yl)-propoxy-phenyl}-1H-benzoimidazole 

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.6043-6048

919088-54-3    68176-57-8   
(1-{3-4-(5-tert-butyl-1H-benzoimidazol-2-yl)-2-chloro-phenoxy-propyl}-pyrrolidin-3-yl)-dimethylamine 

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.6043-6048

Literature
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SDS
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Tags:68176-57-8 Molecular Formula|68176-57-8 MDL|68176-57-8 SMILES|68176-57-8 4-(tert-Butyl)-1,2-diaminobenzene