basic_info |
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| Product_Name： | CAFFEINE SODIUM BENZOATE |
| CAS： | 8000-95-1 |
| EnglishSynonyms： | GUARANINE SODIUM BENZOATE ; 1,3,7-TRIMETHYL-2,6-DIOXOPURINE SODIUM BENZOATE ; METHYLTHEOBROMINE SODIUM BENZOATE ; CAFFEINE SODIUM BENZOATE ; COFFEINE SODIUM BENZOATE ; SODIUM CAFFEINE BENZOATE ; 1,3,7-TRIMETHYLXANTHINE SODIUM BENZOATE ; CAFFEINE AND SODIUM BENZOATE |
| pro_mdlNumber： | MFCD00050906 |
| pro_acceptors： | 6 |
| pro_donors： | 0 |
| pro_smile： | Cn1cnc2c1c(=O)n(c(=O)n2C)C.c1ccc(cc1)C(=O)[O-].[Na+] |
| InChi： | InChI=1S/C8H10N4O2.C7H6O2.Na/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;8-7(9)6-4-2-1-3-5-6;/h4H,1-3H3;1-5H,(H,8,9);/q;;+1/p-1 |
| InChiKey： | InChIKey=JWBPVFVNISJVEM-UHFFFAOYSA-M |
property |
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| Comments： | CONCENTRATION: 50:50 (WT:WT MIXTURE) RTECS: EV6640000 WGK: 3 |
| Concentration： | 50:50 (WT:WT MIXTURE) |
secure_info |
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