8-BROMO-7-(BUT-2-YNYL)-3-METHYL-3,7-DIHYDROPURINE-2,6-DIONE

CAS No.
666816-98-4
CCD No.
CCD07145273
Formula
C10 H9 Br N4 O2
MolWeight
297.111

Basic Information

Product Name: 8-BROMO-7-(BUT-2-YNYL)-3-METHYL-3,7-DIHYDROPURINE-2,6-DIONE
CAS: 666816-98-4
English Synonyms: 8-BROMO-7-(2-BUTYNYL)-3,7-DIHYDRO-3-METHYL-1H-PURINE-2,6-DIONE ; 3-METHYL-7-(2-BUTYN-1-YL)-8-BROMOXANTHINE ; 8-BROMO-7-(BUT-2-YNYL)-3-METHYL-1H-PURINE-2,6(3H,7H)-DIONE ; 8-BROMO-7-(BUT-2-YNYL)-3-METHYL-3,7-DIHYDROPURINE-2,6-DIONE
MDL Number.: MFCD22126091
H bond acceptor: 6
H bond donor: 1
Smile: CC#CCn1c2c(=O)[nH]c(=O)n(c2nc1Br)C
InChi: InChI=1S/C10H9BrN4O2/c1-3-4-5-15-6-7(12-9(15)11)14(2)10(17)13-8(6)16/h5H2,1-2H3,(H,13,16,17)
InChiKey: InChIKey=HFZOBQSHTNNKFY-UHFFFAOYSA-N

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