2-[3-(Dimethylamino)propyl]-1,2,3,6,7,7a-hexahydro-1-oxo-3a,6-epoxy-3aH-isoindole-7-carboxylic acid
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![2-[3-(Dimethylamino)propyl]-1,2,3,6,7,7a-hexahydro-1-oxo-3a,6-epoxy-3aH-isoindole-7-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/3a8a4231ff004f929da33a1bf8929e54.png "2-[3-(Dimethylamino)propyl]-1,2,3,6,7,7a-hexahydro-1-oxo-3a,6-epoxy-3aH-isoindole-7-carboxylic acid")
2-[3-(Dimethylamino)propyl]-1,2,3,6,7,7a-hexahydro-1-oxo-3a,6-epoxy-3aH-isoindole-7-carboxylic acid
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CAS No:
436811-03-9
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Formula:
C14H20N2O4
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Chemical Name:
2-[3-(Dimethylamino)propyl]-1,2,3,6,7,7a-hexahydro-1-oxo-3a,6-epoxy-3aH-isoindole-7-carboxylic acid
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Synonyms:
3a,6-Epoxy-3aH-isoindole-7-carboxylic acid,2-[3-(dimethylamino)propyl]-1,2,3,6,7,7a-hexahydro-1-oxo-;2-[3-(Dimethylamino)propyl]-1,2,3,6,7,7a-hexahydro-1-oxo-3a,6-epoxy-3aH-isoindole-7-carboxylic acid
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CAS No:
2-[3-(Dimethylamino)propyl]-1,2,3,6,7,7a-hexahydro-1-oxo-3a,6-epoxy-3aH-isoindole-7-carboxylic acid Basic Attributes
280.32
280.32
DTXSID80389961
Computed Properties
Molecular Weight:280.32
XLogP3:-3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:280.14230712
Monoisotopic Mass:280.14230712
Topological Polar Surface Area:70.1
Heavy Atom Count:20
Complexity:476
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-[3-(Dimethylamino)propyl]-1,2,3,6,7,7a-hexahydro-1-oxo-3a,6-epoxy-3aH-isoindole-7-carboxylic acid
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