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104968-58-3,MFCD00041077
Catalog No.:AA003ILA

104968-58-3 | 3,5-Dimethoxyphenyl isothiocyanate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$112.00   $78.00
- +
5g
95%
in stock  
$311.00   $218.00
- +
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Technical Information
Catalog Number:
AA003ILA
Chemical Name:
3,5-Dimethoxyphenyl isothiocyanate
CAS Number:
104968-58-3
Molecular Formula:
C9H9NO2S
Molecular Weight:
195.2383
MDL Number:
MFCD00041077
SMILES:
COc1cc(N=C=S)cc(c1)OC
Properties
Properties
 
Form:
Solid  
MP:
49 - 52°C  
Storage:
Keep in dry area;-20 ℃;Inert atmosphere;  

Computed Properties
 
Complexity:
192  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
3  
XLogP3:
3.3  

Literature
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Additional Info:
SDS
Tags:104968-58-3 Molecular Formula|104968-58-3 MDL|104968-58-3 SMILES|104968-58-3 3,5-Dimethoxyphenyl isothiocyanate