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AA00146

1000045-93-1 | Methyl 2-oxo-1,2,3,4-tetrahydroquinoline-7-carboxylate

Packsize Purity Availability Price Discounted Price    Quantity
100mg 95% In Stock US $329.00 $230.00 -   +
250mg 96% In Stock US $343.00 $240.00 -   +
1g 96% In Stock US $858.00 $600.00 -   +

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*All prices are in USD.

Description
Catalog Number: AA00146
Chemical Name: Methyl 2-oxo-1,2,3,4-tetrahydroquinoline-7-carboxylate
CAS Number: 1000045-93-1
Molecular Formula: C11H11NO3
Molecular Weight: 205.2099
MDL Number: MFCD24387120
IUPAC Name: methyl 2-oxo-3,4-dihydro-1H-quinoline-7-carboxylate
InChl: InChI=1S/C11H11NO3/c1-15-11(14)8-3-2-7-4-5-10(13)12-9(7)6-8/h2-3,6H,4-5H2,1H3,(H,12,13)
InChl Key: BUGJUSPLIAWGKT-UHFFFAOYSA-N
SMILES: COC(=O)c1ccc2c(c1)NC(=O)CC2

 

Computed Properties
Complexity: 277  
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Exact Mass: 205.073893g/mol
Formal Charge: 0
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0
Molecular Weight: 205.21g/mol
Monoisotopic Mass: 205.073893g/mol
Rotatable Bond Count: 2  
Topological Polar Surface Area: 55.4Ų
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 0.9  

 

 

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