Home Other Building Blocks 51333-80-3
51333-80-3,MFCD00041079
Catalog No.:AA003I6J

51333-80-3 | 3-(Methylthio)phenyl isothiocyanate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$263.00   $184.00
- +
5g
97%
in stock  
$918.00   $643.00
- +
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Technical Information
Catalog Number:
AA003I6J
Chemical Name:
3-(Methylthio)phenyl isothiocyanate
CAS Number:
51333-80-3
Molecular Formula:
C8H7NS2
Molecular Weight:
181.2779
MDL Number:
MFCD00041079
SMILES:
S=C=Nc1cccc(c1)SC
Properties
Properties
 
BP:
306-307 °C(lit.)  
Form:
Liquid  
Refractive Index:
n20/D >1.3930(lit.)  
Stability:
Moisture Sensitive  
Storage:
Room Temperature;Inert atmosphere;  

Computed Properties
 
Complexity:
164  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
3.9  

Literature
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Additional Info:
SDS
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Tags:51333-80-3 Molecular Formula|51333-80-3 MDL|51333-80-3 SMILES|51333-80-3 3-(Methylthio)phenyl isothiocyanate |Organic_Building_Blocks