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491-45-2,MFCD01543374
Catalog No.:AA003TNY

491-45-2 | Phloroglucide hydrate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$211.00   $148.00
- +
5g
95%
in stock  
$510.00   $357.00
- +
25g
95%
in stock  
$1,407.00   $985.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003TNY
Chemical Name:
Phloroglucide hydrate
CAS Number:
491-45-2
Molecular Formula:
C12H10O5
Molecular Weight:
234.2048
MDL Number:
MFCD01543374
SMILES:
Oc1cc(O)c(c(c1)O)c1cc(O)cc(c1)O
NSC Number:
65069
Properties
Properties
 
Form:
Solid  
MP:
300℃  
Storage:
Room Temperature;Keep in dry area;  

Computed Properties
 
Complexity:
237  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
5  
Rotatable Bond Count:
1  
XLogP3:
1.8  

Literature

Title: In silico identification and biochemical evaluation of novel inhibitors of NRH:quinone oxidoreductase 2 (NQO2).

Journal: Bioorganic & medicinal chemistry letters 20101215

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Tags:491-45-2 Molecular Formula|491-45-2 MDL|491-45-2 SMILES|491-45-2 Phloroglucide hydrate