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13831-59-9,MFCD07783648
Catalog No.:AA0018FT

13831-59-9 | 1-(2-Bromoethoxy)-3-nitrobenzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$59.00   $42.00
- +
25g
98%
in stock  
$139.00   $97.00
- +
100g
98%
in stock  
$393.00 $275.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0018FT
Chemical Name:
1-(2-Bromoethoxy)-3-nitrobenzene
CAS Number:
13831-59-9
Molecular Formula:
C8H8BrNO3
Molecular Weight:
246.0580
MDL Number:
MFCD07783648
SMILES:
BrCCOc1cccc(c1)[N+](=O)[O-]
NSC Number:
111064
Properties
Computed Properties
 
Complexity:
171  
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:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.9  

Downstream Synthesis Route

[1]Baker,B.R.;Ashton,W.T.[JournalofMedicinalChemistry,1970,vol.13,#6,p.1149-1154]

[1]Patent:WO2008/155421,2008,A2.Locationinpatent:Page/Pagecolumn82-83

[1]CurrentPatentAssignee:CHINESEACADEMYOFSCIENCES;ShanghaiInstituteofMateriaMedica(in:CAS)-CN102464631,2016,B

Literature
Quotation Request
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SDS
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Tags:13831-59-9 Molecular Formula|13831-59-9 MDL|13831-59-9 SMILES|13831-59-9 1-(2-Bromoethoxy)-3-nitrobenzene
Catalog No.: AA0018FT
13831-59-9,MFCD07783648
13831-59-9 | 1-(2-Bromoethoxy)-3-nitrobenzene
Pack Size： 5g
Purity： 98%
in stock
$59.00 $42.00
Pack Size： 25g
Purity： 98%
in stock
$139.00 $97.00
Pack Size： 100g
Purity： 98%
in stock
$393.00 $275.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0018FT
Chemical Name: 1-(2-Bromoethoxy)-3-nitrobenzene
CAS Number: 13831-59-9
Molecular Formula: C8H8BrNO3
Molecular Weight: 246.0580
MDL Number: MFCD07783648
SMILES: BrCCOc1cccc(c1)[N+](=O)[O-]
NSC Number: 111064
Properties
Complexity: 171  
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: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.9  
Downstream Synthesis Route
13831-59-9    368-87-6    31185-40-7 

[1]Baker,B.R.;Ashton,W.T.[JournalofMedicinalChemistry,1970,vol.13,#6,p.1149-1154]

13831-59-9    48067-24-9    1093799-21-3 

[1]Patent:WO2008/155421,2008,A2.Locationinpatent:Page/Pagecolumn82-83

13831-59-9    1135283-72-5 

[1]CurrentPatentAssignee:CHINESEACADEMYOFSCIENCES;ShanghaiInstituteofMateriaMedica(in:CAS)-CN102464631,2016,B

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