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Home  > 3,4-(METHYLENEDIOXY)BENZYL ISOTHIOCYANATE

AB63601

4430-47-1 | 3,4-(METHYLENEDIOXY)BENZYL ISOTHIOCYANATE

Packsize Purity Availability Price Discounted Price    Quantity
1g 95% in stock $25.00 $18.00 -   +
5g 95% in stock $79.00 $55.00 -   +

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Description
Catalog Number: AB63601
Chemical Name: 3,4-(METHYLENEDIOXY)BENZYL ISOTHIOCYANATE
CAS Number: 4430-47-1
Molecular Formula: C9H7NO2S
Molecular Weight: 193.2224
MDL Number: MFCD00041217
SMILES: S=C=NCc1ccc2c(c1)OCO2

 

Computed Properties
Complexity: 228  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 4  
Rotatable Bond Count: 2  
XLogP3: 3.3  

 

 

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