2-[[3-(3,4-dimethylphenyl)adamantane-1-carbonyl]amino]benzoic acid
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![2-[[3-(3,4-dimethylphenyl)adamantane-1-carbonyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e105aaf815f74a6488656315918b22b8.png "2-[[3-(3,4-dimethylphenyl)adamantane-1-carbonyl]amino]benzoic acid")
2-[[3-(3,4-dimethylphenyl)adamantane-1-carbonyl]amino]benzoic acid
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CAS No:
50741-83-8
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Formula:
C26H29NO3
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Chemical Name:
2-[[3-(3,4-dimethylphenyl)adamantane-1-carbonyl]amino]benzoic acid
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Synonyms:
50741-83-8;N-(5-(3',4'-Xylyl)-3-adamantoyl)anthranilic acid;N-(5-(3',4'-Xylyl)-3-adamantylcarbonyl)anthranilic acid;Anthranilic acid, N-(5-(3',4'-xylyl)-3-adamantylcarbonyl)-;Benzoic acid, 2-(((3-(3,4-dimethylphenyl)tricyclo(3.3.1.1(sup 3,7))dec-1-yl)carbonyl)amino)-;DTXSID60964977;2-({[3-(3,4-Dimethylphenyl)adamantan-1-yl](hydroxy)methylidene}amino)benzoic acid
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CAS No:
2-[[3-(3,4-dimethylphenyl)adamantane-1-carbonyl]amino]benzoic acid Basic Attributes
403.5 g/mol
403.21474379 g/mol
Computed Properties
Molecular Weight:403.5
XLogP3:6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:403.21474379
Monoisotopic Mass:403.21474379
Topological Polar Surface Area:66.4
Heavy Atom Count:30
Complexity:688
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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