2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoacetic acid
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2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoacetic acid
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CAS No:
603097-44-5
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Formula:
C11H11NO3
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Chemical Name:
2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoacetic acid
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Synonyms:
3,4-dihydroisoquinolin-2(1H)-yl(oxo)acetic acid;
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CAS No:
2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoacetic acid Basic Attributes
205.21000
205.07389321
DTXSID60396855
2933499090
Computed Properties
Molecular Weight:205.21
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:205.07389321
Monoisotopic Mass:205.07389321
Topological Polar Surface Area:57.6
Heavy Atom Count:15
Complexity:277
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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