3-[2-(2,6-dimethylphenoxy)ethyl]-4-oxophthalazine-1-carboxylic acid
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![3-[2-(2,6-dimethylphenoxy)ethyl]-4-oxophthalazine-1-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/47f167ac91d64fe78304a2f7829cf8cd.png "3-[2-(2,6-dimethylphenoxy)ethyl]-4-oxophthalazine-1-carboxylic acid")
3-[2-(2,6-dimethylphenoxy)ethyl]-4-oxophthalazine-1-carboxylic acid
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CAS No:
796116-87-5
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Formula:
C19H18N2O4
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Chemical Name:
3-[2-(2,6-dimethylphenoxy)ethyl]-4-oxophthalazine-1-carboxylic acid
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Synonyms:
SMR000154461;MLS000568175;CHEMBL1586554;REGID_for_CID_2438929;HMS2283C18;ZINC3323468;MCULE-4185637295;Z19629880;3-[2-(2,6-dimethylphenoxy)ethyl]-4-oxo-3,4-dihydrophthalazine-1-carboxylic acid;796116-87-5
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CAS No:
3-[2-(2,6-dimethylphenoxy)ethyl]-4-oxophthalazine-1-carboxylic acid Basic Attributes
338.4 g/mol
338.12665706 g/mol
Computed Properties
Molecular Weight:338.4
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:338.12665706
Monoisotopic Mass:338.12665706
Topological Polar Surface Area:79.2
Heavy Atom Count:25
Complexity:538
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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