2-[[2-(3-bromo-1-adamantyl)acetyl]amino]benzoic acid
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![2-[[2-(3-bromo-1-adamantyl)acetyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8b21f092c323478092a3ec0158124958.png "2-[[2-(3-bromo-1-adamantyl)acetyl]amino]benzoic acid")
2-[[2-(3-bromo-1-adamantyl)acetyl]amino]benzoic acid
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CAS No:
50741-85-0
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Formula:
C19H22BrNO3
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Chemical Name:
2-[[2-(3-bromo-1-adamantyl)acetyl]amino]benzoic acid
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CAS No:
2-[[2-(3-bromo-1-adamantyl)acetyl]amino]benzoic acid Basic Attributes
392.28700
391.07831 g/mol
2924299090
Computed Properties
Molecular Weight:392.3
XLogP3:4.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:391.07831
Monoisotopic Mass:391.07831
Topological Polar Surface Area:66.4
Heavy Atom Count:24
Complexity:535
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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