Basic Information |
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| Product Name: | THEOBROMINE SODIUM ACETATE |
| CAS: | 8002-88-8 |
| English Synonyms: | THEOBROMINE SODIUM ACETATE |
| MDL Number.: | MFCD01743430 |
| H bond acceptor: | 6 |
| H bond donor: | 0 |
| Smile: | CC(=O)[O-].Cn1cnc2c1c(=O)n(c(=O)n2C)[Na].[Na+] |
| InChi: | InChI=1S/C7H8N4O2.C2H4O2.2Na/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2;1-2(3)4;;/h3H,1-2H3,(H,9,12,13);1H3,(H,3,4);;/q;;2*+1/p-2 |
| InChiKey: | InChIKey=BQWXDQUPYCHWGB-UHFFFAOYSA-L |
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