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90561-85-6,MFCD00015924
Catalog No.:AA003GLZ

90561-85-6 | 3-Bromo-2,4,6-trimethylnitrobenzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$195.00   $137.00
- +
5g
95%
in stock  
$660.00 $462.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003GLZ
Chemical Name:
3-Bromo-2,4,6-trimethylnitrobenzene
CAS Number:
90561-85-6
Molecular Formula:
C9H10BrNO2
Molecular Weight:
244.0852
MDL Number:
MFCD00015924
SMILES:
[O-][N+](=O)c1c(C)cc(c(c1C)Br)C
Properties
Properties
 
BP:
106-107°C at 1.3mm Hg(lit.)  
Form:
Solid  
MP:
59-64°C(lit.)  

Computed Properties
 
Complexity:
204  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.5  

Downstream Synthesis Route

[1]Bruice[JournalofOrganicChemistry,1958,vol.23,p.246]

[1]Bruice[JournalofOrganicChemistry,1958,vol.23,p.246]

[2]Fittig;Storer[JustusLiebigsAnnalenderChemie,1868,vol.147,p.8]

90561-85-6   
2,4,6-trimethyl-3-phenoxy-aniline 

[1]Bruice[JournalofOrganicChemistry,1958,vol.23,p.246]

[1]CurrentPatentAssignee:PFIZERINC-US2005/49286,2005,A1

Literature
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SDS
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Tags:90561-85-6 Molecular Formula|90561-85-6 MDL|90561-85-6 SMILES|90561-85-6 3-Bromo-2,4,6-trimethylnitrobenzene
Catalog No.: AA003GLZ
90561-85-6,MFCD00015924
90561-85-6 | 3-Bromo-2,4,6-trimethylnitrobenzene
Pack Size： 1g
Purity： 95%
in stock
$195.00 $137.00
Pack Size： 5g
Purity： 95%
in stock
$660.00 $462.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003GLZ
Chemical Name: 3-Bromo-2,4,6-trimethylnitrobenzene
CAS Number: 90561-85-6
Molecular Formula: C9H10BrNO2
Molecular Weight: 244.0852
MDL Number: MFCD00015924
SMILES: [O-][N+](=O)c1c(C)cc(c(c1C)Br)C
Properties
BP: 106-107°C at 1.3mm Hg(lit.)  
Form: Solid  
MP: 59-64°C(lit.)  
Complexity: 204  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.5  
Downstream Synthesis Route
112-36-7    90561-85-6    139-02-6    101090-25-9 

[1]Bruice[JournalofOrganicChemistry,1958,vol.23,p.246]

576-83-0    90561-85-6 

[1]Bruice[JournalofOrganicChemistry,1958,vol.23,p.246]

[2]Fittig;Storer[JustusLiebigsAnnalenderChemie,1868,vol.147,p.8]

90561-85-6   
2,4,6-trimethyl-3-phenoxy-aniline 

[1]Bruice[JournalofOrganicChemistry,1958,vol.23,p.246]

90561-85-6    34874-87-8 

[1]CurrentPatentAssignee:PFIZERINC-US2005/49286,2005,A1

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