2-[(2S)-1-methylpyrrolidin-2-yl]benzoic acid
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![2-[(2S)-1-methylpyrrolidin-2-yl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/648c2916ab9147f98e9878648ca2d5d4.png "2-[(2S)-1-methylpyrrolidin-2-yl]benzoic acid")
2-[(2S)-1-methylpyrrolidin-2-yl]benzoic acid
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CAS No:
83807-63-0
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Formula:
C12H15NO2
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Chemical Name:
2-[(2S)-1-methylpyrrolidin-2-yl]benzoic acid
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Synonyms:
83807-63-0;Dihydroshihunine;Benzoic acid, 2-(1-methyl-2-pyrrolidinyl)-, (S)-;DTXSID101003880;2-(1-methylpyrrolidin-2-yl)benzoic acid
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CAS No:
Computed Properties
Molecular Weight:205.25
XLogP3:-0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:205.110278721
Monoisotopic Mass:205.110278721
Topological Polar Surface Area:40.5
Heavy Atom Count:15
Complexity:242
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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