112054-78-1
Catalog No.:AA008WI6

112054-78-1 | N-Acetyl-9-(acetylaMino)-9-deoxyneuraMinic Acid

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Technical Information
Catalog Number:
AA008WI6
Chemical Name:
N-Acetyl-9-(acetylaMino)-9-deoxyneuraMinic Acid
CAS Number:
112054-78-1
Molecular Formula:
C13H22N2O9
Molecular Weight:
350.3218
SMILES:
CC(=O)NC[C@H]([C@H](C1OC(O)(CC(C1NC(=O)C)O)C(=O)O)O)O
Properties
Computed Properties
 
Complexity:
500  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
7  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0  
XLogP3:
-3.5  

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Tags:112054-78-1 Molecular Formula|112054-78-1 MDL|112054-78-1 SMILES|112054-78-1 N-Acetyl-9-(acetylaMino)-9-deoxyneuraMinic Acid
Catalog No.: AA008WI6
112054-78-1
112054-78-1 | N-Acetyl-9-(acetylaMino)-9-deoxyneuraMinic Acid
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA008WI6
Chemical Name: N-Acetyl-9-(acetylaMino)-9-deoxyneuraMinic Acid
CAS Number: 112054-78-1
Molecular Formula: C13H22N2O9
Molecular Weight: 350.3218
SMILES: CC(=O)NC[C@H]([C@H](C1OC(O)(CC(C1NC(=O)C)O)C(=O)O)O)O
Properties
Complexity: 500  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 2  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 24  
Hydrogen Bond Acceptor Count: 9  
Hydrogen Bond Donor Count: 7  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 4  
Undefined Bond Stereocenter Count: 0  
XLogP3: -3.5  
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