3-(2,3,4-trimethoxy-6-oxo-5,7,8,9-tetrahydrobenzo[7]annulen-5-yl)propanoic acid
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![3-(2,3,4-trimethoxy-6-oxo-5,7,8,9-tetrahydrobenzo[7]annulen-5-yl)propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/03d5c5d723694980b7ffb97085584c75.png "3-(2,3,4-trimethoxy-6-oxo-5,7,8,9-tetrahydrobenzo[7]annulen-5-yl)propanoic acid")
3-(2,3,4-trimethoxy-6-oxo-5,7,8,9-tetrahydrobenzo[7]annulen-5-yl)propanoic acid
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CAS No:
972-63-4
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Formula:
C17H22O6
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Chemical Name:
3-(2,3,4-trimethoxy-6-oxo-5,7,8,9-tetrahydrobenzo[7]annulen-5-yl)propanoic acid
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Synonyms:
972-63-4;BRN 1662704;3-(2,3,4-trimethoxy-6-oxo-6,7,8,9-tetrahydro-5h-benzo[7]annulen-5-yl)propanoic acid;beta-(6-Oxo-2,3,4-trimethoxybenzocycloheptan-5-yl)propionic acid;5H-Benzocycloheptene-5-propanoic acid, 6,7,8,9-tetrahydro-6-oxo-2,3,4-trimethoxy-;6,7,8,9-Tetrahydro-6-oxo-2,3,4-trimethoxy-5H-benzocycloheptene-5-propanoic acid;6-Oxo-2,3,4-trimethoxy-6,7,8,9-tetrahydro-5H-benzocycloheptene-5-propanoic acid;DTXSID20914059
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CAS No:
3-(2,3,4-trimethoxy-6-oxo-5,7,8,9-tetrahydrobenzo[7]annulen-5-yl)propanoic acid Basic Attributes
322.4 g/mol
322.14163842 g/mol
Computed Properties
Molecular Weight:322.4
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:322.14163842
Monoisotopic Mass:322.14163842
Topological Polar Surface Area:82.1
Heavy Atom Count:23
Complexity:423
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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