三-O-乙酰基-1-溴-1-脱氧-α-D-吡喃葡萄糖醛酸甲酯（CAS 21085-72-3）：分子式 C13H17BrO9、分子量 397.17。
| CAS号 | 21085-72-3 |
|---|---|
| 分子式 | C13H17BrO9 |
| 分子量 | 397.17 |
| LogP | 0.6 |
三-O-乙酰基-1-溴-1-脱氧-α-D-吡喃葡萄糖醛酸甲酯 是一种化工化合物，登记 CAS 号为 21085-72-3，分子式 C13H17BrO9（分子量 397.17）。
登记 CAS 号：21085-72-3
其分子式 C13H17BrO9 由 13 个碳、17 个氢、1 个溴、9 个氧 组成。
别名/同义词：三-O-乙酰基-1-溴-1-脱氧-α-D-吡喃葡萄糖醛酸甲酯 · methyl tri-O-acetyl-1-bromo-1-deoxy-α-D-glucopyranuronate
三-O-乙酰基-1-溴-1-脱氧-α-D-吡喃葡萄糖醛酸甲酯 的 CAS 登记号为 21085-72-3。
分子式 C13H17BrO9，分子量 397.17。
别名/同义词：三-O-乙酰基-1-溴-1-脱氧-α-D-吡喃葡萄糖醛酸甲酯、methyl tri-O-acetyl-1-bromo-1-deoxy-α-D-glucopyranuronate。
三-O-乙酰基-1-溴-1-脱氧-α-D-吡喃葡萄糖醛酸甲酯（CAS 21085-72-3）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 21085-72-3 |
|---|---|
| PubChem CID | 88785 |
| Molecular formula | C13H17BrO9 |
| IUPAC name | methyl (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-bromooxane-2-carboxylate |
| Molecular Weight | 397.17 |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 8 |
| Exact Mass | 396.00559 |
| Monoisotopic Mass | 396.00559 |
| Topological Polar Surface Area | 114 |
| Heavy Atom Count | 23 |
Acetobromo-alpha-D-glucuronic acid methyl ester; DTXSID401260289; alpha-D-Glucopyranuronic acid, 1-bromo-1-deoxy-, methyl ester, triacetate; RefChem:552370; DTXCID801690997; .alpha.-D-Glucopyranuronic acid, 1-bromo-1-deoxy-, methyl ester, triacetate; 21085-72-3; (2R,3R,4S,5S,6S)-2-Bromo-6-(methoxycarbonyl)tetrahydro-2H-pyran-3,4,5-triyl triacetate; Methyl acetobromo-alpha-D-glucuronate; MFCD00061613; Acetobromo-|A-D-glucuronic acid methyl ester; AKOS016010256; H10617; methyl (2S,3S,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-bromooxane-2-carboxylate; C13H17BrO9; ACETOBROMO-A-D-GLUCURONIC ACID METHYL ESTER
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
methyl tri-O-acetyl-1-bromo-1-deoxy-α-D-glucopyranuronate · CAS 21085-72-3 · C13H17BrO9.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: methyl tri-O-acetyl-1-bromo-1-deoxy-α-D-glucopyranuronate