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588715-55-3,MFCD03945365
Catalog No.:AA00JBX7

588715-55-3 | Methyl 2-isothiocyanato-5-phenylthiophene-3-carboxylate

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Purity
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500mg
1 week  
$409.00   $287.00
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Technical Information
Catalog Number:
AA00JBX7
Chemical Name:
Methyl 2-isothiocyanato-5-phenylthiophene-3-carboxylate
CAS Number:
588715-55-3
Molecular Formula:
C13H9NO2S2
Molecular Weight:
275.3461
MDL Number:
MFCD03945365
SMILES:
S=C=Nc1sc(cc1C(=O)OC)c1ccccc1
Properties
Computed Properties
 
Complexity:
349  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
4  
XLogP3:
4.9  

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SDS
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Tags:588715-55-3 Molecular Formula|588715-55-3 MDL|588715-55-3 SMILES|588715-55-3 Methyl 2-isothiocyanato-5-phenylthiophene-3-carboxylate