Home Bromides 52805-45-5
52805-45-5,MFCD01123027
Catalog No.:AA003IZ4

52805-45-5 | 3-Bromo-4-hydroxy-5-methoxybenzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$62.00   $44.00
- +
5g
97%
in stock  
$150.00   $105.00
- +
10g
97%
in stock  
$248.00   $174.00
- +
25g
97%
in stock  
$479.00   $335.00
- +
100g
97%
in stock  
$1,574.00   $1,102.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003IZ4
Chemical Name:
3-Bromo-4-hydroxy-5-methoxybenzonitrile
CAS Number:
52805-45-5
Molecular Formula:
C8H6BrNO2
Molecular Weight:
228.0427
MDL Number:
MFCD01123027
SMILES:
COc1cc(C#N)cc(c1O)Br
Properties
Properties
 
Form:
Solid  
MP:
143-146 °C  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
201  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.9  

Downstream Synthesis Route

[1]Brady;Dunn[JournaloftheChemicalSociety,1915,vol.107,p.1859]

[1]Gao,Hongping;Su,Ping;Shi,Yaling;Shen,Xiuxiu;Zhang,Yanmin;Dong,Jinyun;Zhang,Jie[EuropeanJournalofMedicinalChemistry,2015,vol.90,p.232-240]

Literature
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Additional Info:
SDS
Tags:52805-45-5 Molecular Formula|52805-45-5 MDL|52805-45-5 SMILES|52805-45-5 3-Bromo-4-hydroxy-5-methoxybenzonitrile |Organic_Building_Blocks