8-[(4-aminophenyl)methyl]-1,3-dimethyl-7H-purine-2,6-dione
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![8-[(4-aminophenyl)methyl]-1,3-dimethyl-7H-purine-2,6-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ad808df5bc424874b880a08d7673fe45.png "8-[(4-aminophenyl)methyl]-1,3-dimethyl-7H-purine-2,6-dione")
8-[(4-aminophenyl)methyl]-1,3-dimethyl-7H-purine-2,6-dione
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CAS No:
6937-57-1
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Formula:
C14H15N5O2
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Chemical Name:
8-[(4-aminophenyl)methyl]-1,3-dimethyl-7H-purine-2,6-dione
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Synonyms:
8-(4-amino-benzyl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione; 8-(4-aminobenzyl)-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione; 8-(4-Amino-benzyl)-1,3-dimethyl-3,7-dihydro-purin-2,6-dion; Theophylline,8-(p-aminobenzyl);
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CAS No:
8-[(4-aminophenyl)methyl]-1,3-dimethyl-7H-purine-2,6-dione Basic Attributes
285.30100
285.12257474 g/mol
14388
DTXSID60279876
Computed Properties
Molecular Weight:285.30
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:285.12257474
Monoisotopic Mass:285.12257474
Topological Polar Surface Area:95.3
Heavy Atom Count:21
Complexity:435
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 8-[(4-aminophenyl)methyl]-1,3-dimethyl-7H-purine-2,6-dione
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