2-(1,1-Dimethylethyl) 3,4-dihydro-7-iodo-2,3(1H)-isoquinolinedicarboxylate
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2-(1,1-Dimethylethyl) 3,4-dihydro-7-iodo-2,3(1H)-isoquinolinedicarboxylate
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CAS No:
228728-16-3
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Formula:
C15H18INO4
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Chemical Name:
2-(1,1-Dimethylethyl) 3,4-dihydro-7-iodo-2,3(1H)-isoquinolinedicarboxylate
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Synonyms:
2,3(1H)-Isoquinolinedicarboxylic acid,3,4-dihydro-7-iodo-,2-(1,1-dimethylethyl) ester;2-(1,1-Dimethylethyl) 3,4-dihydro-7-iodo-2,3(1H)-isoquinolinedicarboxylate;2-Boc-7-iodo-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
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CAS No:
2-(1,1-Dimethylethyl) 3,4-dihydro-7-iodo-2,3(1H)-isoquinolinedicarboxylate Basic Attributes
403.216
403.21
Computed Properties
Molecular Weight:403.21
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:403.02806
Monoisotopic Mass:403.02806
Topological Polar Surface Area:66.8
Heavy Atom Count:21
Complexity:420
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-(1,1-Dimethylethyl) 3,4-dihydro-7-iodo-2,3(1H)-isoquinolinedicarboxylate
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