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93221-21-7,MFCD09952966
Catalog No.:AA01E9E9

93221-21-7 | 2,3,4,6-Tetra-O-acetyl-a-D-mannopyranosyl isothiocyanate

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Technical Information
Catalog Number:
AA01E9E9
Chemical Name:
2,3,4,6-Tetra-O-acetyl-a-D-mannopyranosyl isothiocyanate
CAS Number:
93221-21-7
Molecular Formula:
C15H19NO9S
Molecular Weight:
389.3777
MDL Number:
MFCD09952966
SMILES:
CC(=O)OCC1C(C(C(C(O1)N=C=S)OC(=O)C)OC(=O)C)OC(=O)C
Properties
Computed Properties
 
Complexity:
616  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
11  
Rotatable Bond Count:
10  
XLogP3:
1.2  

Literature
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Additional Info:
SDS
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Tags:93221-21-7 Molecular Formula|93221-21-7 MDL|93221-21-7 SMILES|93221-21-7 2,3,4,6-Tetra-O-acetyl-a-D-mannopyranosyl isothiocyanate