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Home Imidazoles 17452-14-1
17452-14-1,MFCD00041376
Catalog No.:AA001ZO3

17452-14-1 | 1-(4-Methoxyphenyl)-1h-imidazole-2-thiol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$49.00   $34.00
- +
1g
98%
in stock  
$83.00   $58.00
- +
5g
95%
in stock  
$344.00   $241.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001ZO3
Chemical Name:
1-(4-Methoxyphenyl)-1h-imidazole-2-thiol
CAS Number:
17452-14-1
Molecular Formula:
C10H10N2OS
Molecular Weight:
206.2642
MDL Number:
MFCD00041376
SMILES:
COc1ccc(cc1)n1cc[nH]c1=S
Properties
Properties
 
BP:
336.6°C at 760 mmHg  
Form:
Solid  
MP:
216-217 °C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
247  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.5  

Downstream Synthesis Route
3347-62-4    17452-14-1   
K(1+)*HB(C3H2N2(S)(CH3OC6H4))2(C3HN2(CH3)C6H5)(1-)=KHB(C3H2N2(S)(CH3OC6H4))2(C3HN2(CH3)C6H5) 

[1]EuropeanJournalofInorganicChemistry,2003,p.2502-2511

potassiumborohydride 
  3347-62-4    17452-14-1   
K(1+)*HB(C3H2N2(S)(CH3OC6H4))2(C3HN2(CH3)C6H5)(1-)=KHB(C3H2N2(S)(CH3OC6H4))2(C3HN2(CH3)C6H5) 

[1]EuropeanJournalofInorganicChemistry,2003,p.2502-2511

[1]Locationinpatent:experimentalpartZhan,Peng;Liu,Xinyong;Zhu,Junjie;Fang,Zengjun;Li,Zhenyu;Pannecouque,Christophe;Clercq,ErikDe[BioorganicandMedicinalChemistry,2009,vol.17,#16,p.5775-5781]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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