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1005134-08-6,MFCD05990278
Catalog No.:AA00024M

1005134-08-6 | (2-Methyl-3,5-dioxo-4-azatricyclo[5.2.1.0(2,6)]dec-8-en-4-yl)acetic acid

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Technical Information
Catalog Number:
AA00024M
Chemical Name:
(2-Methyl-3,5-dioxo-4-azatricyclo[5.2.1.0(2,6)]dec-8-en-4-yl)acetic acid
CAS Number:
1005134-08-6
Molecular Formula:
C12H13NO4
Molecular Weight:
235.2359
MDL Number:
MFCD05990278
SMILES:
OC(=O)CN1C(=O)C2C(C1=O)(C)C1CC2C=C1
Properties
Computed Properties
 
Complexity:
469  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
4  
XLogP3:
0.2  

Literature
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SDS
Tags:1005134-08-6 Molecular Formula|1005134-08-6 MDL|1005134-08-6 SMILES|1005134-08-6 (2-Methyl-3,5-dioxo-4-azatricyclo[5.2.1.0(2,6)]dec-8-en-4-yl)acetic acid