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4139-61-1,MFCD00239372
Catalog No.:AA00I80N

4139-61-1 | 6-Bromo-4-hydroxycoumarin

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$12.00   $8.00
- +
250mg
95%
in stock  
$21.00   $15.00
- +
1g
98%
in stock  
$62.00   $44.00
- +
5g
in stock  
$193.00   $135.00
- +
25g
≥ 95% (HPLC)
in stock  
$779.00   $546.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00I80N
Chemical Name:
6-Bromo-4-hydroxycoumarin
CAS Number:
4139-61-1
Molecular Formula:
C9H5BrO3
Molecular Weight:
241.0382
MDL Number:
MFCD00239372
SMILES:
Brc1ccc2c(c1)c(O)cc(=O)o2
Properties
Computed Properties
 
Complexity:
262  
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:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2  

Downstream Synthesis Route
50-00-0    4139-61-1   
bis-(6-bromo-2,4-dioxo-chroman-3-yl)-methane 

[1]JournaloftheAmericanChemicalSociety,1944,vol.66,p.656

4139-61-1    141-82-2   
9-bromo-pyrano3,2-<i>c</i>chromene-2,4,5-trione 

[1]MonatsheftefurChemie,1956,vol.87,p.386,390

[1]JournalofMedicinalChemistry,1964,vol.7,p.284-288

4139-61-1   
2-4-(<i>N</i>-acetyl-anilino)-buta-1,3-dienyl-3-methyl-benzooxazolium;iodide 
  4699-04-1 

[1]IndianJournalofChemistry,1965,vol.3,p.461-462

[1]IndianJournalofChemistry,1965,vol.3,p.461-462

Literature
Quotation Request
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Quantity Required:
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Additional Info:
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SDS
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Tags:4139-61-1 Molecular Formula|4139-61-1 MDL|4139-61-1 SMILES|4139-61-1 6-Bromo-4-hydroxycoumarin
Catalog No.: AA00I80N
4139-61-1,MFCD00239372
4139-61-1 | 6-Bromo-4-hydroxycoumarin
Pack Size： 100mg
Purity： 95%
in stock
$12.00 $8.00
Pack Size： 250mg
Purity： 95%
in stock
$21.00 $15.00
Pack Size： 1g
Purity： 98%
in stock
$62.00 $44.00
Pack Size： 5g
Purity：
in stock
$193.00 $135.00
Pack Size： 25g
Purity： ≥ 95% (HPLC)
in stock
$779.00 $546.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00I80N
Chemical Name: 6-Bromo-4-hydroxycoumarin
CAS Number: 4139-61-1
Molecular Formula: C9H5BrO3
Molecular Weight: 241.0382
MDL Number: MFCD00239372
SMILES: Brc1ccc2c(c1)c(O)cc(=O)o2
Properties
Complexity: 262  
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: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2  
Downstream Synthesis Route
50-00-0    4139-61-1   
bis-(6-bromo-2,4-dioxo-chroman-3-yl)-methane 

[1]JournaloftheAmericanChemicalSociety,1944,vol.66,p.656

4139-61-1    141-82-2   
9-bromo-pyrano3,2-<i>c</i>chromene-2,4,5-trione 

[1]MonatsheftefurChemie,1956,vol.87,p.386,390

1121-60-4    4139-61-1    95943-30-9 

[1]JournalofMedicinalChemistry,1964,vol.7,p.284-288

4139-61-1   
2-4-(<i>N</i>-acetyl-anilino)-buta-1,3-dienyl-3-methyl-benzooxazolium;iodide 
  4699-04-1 

[1]IndianJournalofChemistry,1965,vol.3,p.461-462

4139-61-1    71467-45-3    5003-07-6 

[1]IndianJournalofChemistry,1965,vol.3,p.461-462

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