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4186-54-3,MFCD00059612
Catalog No.:AA003NOG

4186-54-3 | Alpha,3,5-tribromo-2-hydroxytoluene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$58.00   $40.00
- +
5g
98%
in stock  
$86.00   $60.00
- +
25g
>98.0%(GC)(T)
in stock  
$163.00   $114.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003NOG
Chemical Name:
Alpha,3,5-tribromo-2-hydroxytoluene
CAS Number:
4186-54-3
Molecular Formula:
C7H5Br3O
Molecular Weight:
344.8260
MDL Number:
MFCD00059612
SMILES:
BrCc1cc(Br)cc(c1O)Br
Properties
Properties
 
BP:
330.6°C at 760 mmHg  

Computed Properties
 
Complexity:
131  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.5  

Downstream Synthesis Route
4186-54-3    42870-65-5   
2,4-Dibromo-6-(cycloheptyl-methyl-amino)-methyl-phenol 

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-CH597148,1978,A5[Chem.Abstr.,1975,vol.83,#192811][Chem.Abstr.,1975,vol.83,#192811]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-DE2251891,1974,A1[Chem.Abstr.,1974,vol.81,#25327][Chem.Abstr.,1974,vol.81,#25327]

[1]JournalofOrganicChemistry,1961,vol.26,p.2966-2969

[1]Capuano,Lilly;Ahlhelm,Alfred;Hartmann,Herbert[ChemischeBerichte,1986,vol.119,#6,p.2069-2074]

[1]Capuano,Lilly;Ahlhelm,Alfred;Hartmann,Herbert[ChemischeBerichte,1986,vol.119,#6,p.2069-2074]

[1]Gu,Xin;Zhang,Yan;Xu,Zhen-Jiang;Che,Chi-Ming[ChemicalCommunications,2014,vol.50,#58,p.7870-7873]

Literature
Quotation Request
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SDS
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Tags:4186-54-3 Molecular Formula|4186-54-3 MDL|4186-54-3 SMILES|4186-54-3 Alpha,3,5-tribromo-2-hydroxytoluene
Catalog No.: AA003NOG
4186-54-3,MFCD00059612
4186-54-3 | Alpha,3,5-tribromo-2-hydroxytoluene
Pack Size： 1g
Purity： 98%
in stock
$58.00 $40.00
Pack Size： 5g
Purity： 98%
in stock
$86.00 $60.00
Pack Size： 25g
Purity： >98.0%(GC)(T)
in stock
$163.00 $114.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003NOG
Chemical Name: Alpha,3,5-tribromo-2-hydroxytoluene
CAS Number: 4186-54-3
Molecular Formula: C7H5Br3O
Molecular Weight: 344.8260
MDL Number: MFCD00059612
SMILES: BrCc1cc(Br)cc(c1O)Br
Properties
BP: 330.6°C at 760 mmHg  
Complexity: 131  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.5  
Downstream Synthesis Route
4186-54-3    42870-65-5   
2,4-Dibromo-6-(cycloheptyl-methyl-amino)-methyl-phenol 

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-CH597148,1978,A5[Chem.Abstr.,1975,vol.83,#192811][Chem.Abstr.,1975,vol.83,#192811]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-DE2251891,1974,A1[Chem.Abstr.,1974,vol.81,#25327][Chem.Abstr.,1974,vol.81,#25327]

4186-54-3    608-33-3    91261-00-6 

[1]JournalofOrganicChemistry,1961,vol.26,p.2966-2969

4186-54-3    75630-71-6 

[1]Capuano,Lilly;Ahlhelm,Alfred;Hartmann,Herbert[ChemischeBerichte,1986,vol.119,#6,p.2069-2074]

4186-54-3    7203-79-4 

[1]Capuano,Lilly;Ahlhelm,Alfred;Hartmann,Herbert[ChemischeBerichte,1986,vol.119,#6,p.2069-2074]

4186-54-3    137037-20-8    1617519-28-4 

[1]Gu,Xin;Zhang,Yan;Xu,Zhen-Jiang;Che,Chi-Ming[ChemicalCommunications,2014,vol.50,#58,p.7870-7873]

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