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16220-05-6,MFCD00126014
Catalog No.:AA001ST3

16220-05-6 | (2-Isothiocyanatopropyl)benzene

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Technical Information
Catalog Number:
AA001ST3
Chemical Name:
(2-Isothiocyanatopropyl)benzene
CAS Number:
16220-05-6
Molecular Formula:
C10H11NS
Molecular Weight:
177.2660
MDL Number:
MFCD00126014
SMILES:
CC(Cc1ccccc1)N=C=S
Properties
Computed Properties
 
Complexity:
167  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
4  

Literature
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SDS
Tags:16220-05-6 Molecular Formula|16220-05-6 MDL|16220-05-6 SMILES|16220-05-6 (2-Isothiocyanatopropyl)benzene