8-(chloromethyl)-1,3-dimethyl-7H-purine-2,6-dione
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8-(chloromethyl)-1,3-dimethyl-7H-purine-2,6-dione
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CAS No:
64398-14-7
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Formula:
C8H9ClN4O2
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Chemical Name:
8-(chloromethyl)-1,3-dimethyl-7H-purine-2,6-dione
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Synonyms:
64398-14-7;8-(chloromethyl)-1,3-dimethyl-7H-purine-2,6-dione;1H-Purine-2,6-dione, 8-(chloromethyl)-3,7-dihydro-1,3-dimethyl-;8-(chloromethyl)-1,3-dimethyl-2,3,6,9-tetrahydro-1H-purine-2,6-dione;NSC62585;8-Chlormethyl-theophyllin;NCIOpen2_002648;DTXSID40214609;8-(Chloromethyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione;ZINC8616071;NSC 62585;NSC-62585;AKOS008104999;MCULE-4828562811;NE14706;EN300-31037;1H-Purine-2, 8-(chloromethyl)-3,7-dihydro-1,3-dimethyl-
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CAS No:
8-(chloromethyl)-1,3-dimethyl-7H-purine-2,6-dione Basic Attributes
228.63 g/mol
228.0414032 g/mol
62585
DTXSID40214609
Computed Properties
Molecular Weight:228.63
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:228.0414032
Monoisotopic Mass:228.0414032
Topological Polar Surface Area:69.3
Heavy Atom Count:15
Complexity:311
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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