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95168-26-6,MFCD28125235
Catalog No.:AA01BGP5

95168-26-6 | 3,3-diethyl 4-hydroxy-1-oxo-3,4-dihydro-1H-2-benzopyran-3,3-dicarboxylate

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Technical Information
Catalog Number:
AA01BGP5
Chemical Name:
3,3-diethyl 4-hydroxy-1-oxo-3,4-dihydro-1H-2-benzopyran-3,3-dicarboxylate
CAS Number:
95168-26-6
Molecular Formula:
C15H16O7
Molecular Weight:
308.2833
MDL Number:
MFCD28125235
SMILES:
CCOC(=O)C1(OC(=O)c2c(C1O)cccc2)C(=O)OCC
Properties
Computed Properties
 
Complexity:
441  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.8  

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SDS
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Tags:95168-26-6 Molecular Formula|95168-26-6 MDL|95168-26-6 SMILES|95168-26-6 3,3-diethyl 4-hydroxy-1-oxo-3,4-dihydro-1H-2-benzopyran-3,3-dicarboxylate