1,4,7,10-四氮杂环十二烷-1,4,7,10-四乙酸(CAS 60239-18-1):分子式 C16H28N4O8、分子量 404.42。
| CAS号 | 60239-18-1 |
|---|---|
| 分子式 | C16H28N4O8 |
| 分子量 | 404.42 |
| LogP | -10.6 |
| 应用领域 | Uses: Use (kg、approx.) in Germany (2009): >1000、Consumption (g per capita、approx.) in Germany (2009): 0.0122、Excretion rate: 0.95、Calculated removal (%): 22 |
登记用途:Uses: Use (kg、approx.) in Germany (2009): >1000、Consumption (g per capita、approx.) in Germany (2009): 0.0122、Excretion rate: 0.95、Calculated removal (%): 22。
1,4,7,10-四氮杂环十二烷-1,4,7,10-四乙酸 是一种化工化合物,登记 CAS 号为 60239-18-1,分子式 C16H28N4O8(分子量 404.42)。
登记 CAS 号:60239-18-1
其分子式 C16H28N4O8 由 16 个碳、28 个氢、4 个氮、8 个氧 组成。
别名/同义词:1,4,7,10-四氮杂环十二烷-1,4,7,10-四乙酸 · 1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetic acid
1,4,7,10-四氮杂环十二烷-1,4,7,10-四乙酸 的 CAS 登记号为 60239-18-1。
分子式 C16H28N4O8,分子量 404.42。
别名/同义词:1,4,7,10-四氮杂环十二烷-1,4,7,10-四乙酸、1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetic acid。
登记用途:Uses: Use (kg、approx.) in Germany (2009): >1000、Consumption (g per capita、approx.) in Germany (2009): 0.0122、Excretion rate: 0.95、Calculated removal (%): 22。
1,4,7,10-四氮杂环十二烷-1,4,7,10-四乙酸(CAS 60239-18-1)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 60239-18-1 |
|---|---|
| PubChem CID | 121841 |
| Molecular formula | C16H28N4O8 |
| IUPAC name | 2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid |
| UNII (FDA) | 1HTE449DGZ |
| Molecular Weight | 404.42 |
|---|---|
| XLogP3 | -10.6 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 8 |
| Exact Mass | 404.19071386 |
| Monoisotopic Mass | 404.19071386 |
| Topological Polar Surface Area | 162 |
| Heavy Atom Count | 28 |
DOTA; Tetraxetan; 60239-18-1; 1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic acid; Dota acid; 2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid; 1,4,7,10-Tetraazacyclododecane-N,N',N'',N'''-tetraacetic acid; 1,4,7,10-Dota; 2,2',2'',2'''-(1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrayl)tetraacetic acid; DOT-A; 1HTE449DGZ; NSC-681107; CHEBI:61028; DTXSID60208984; 2,2',2'',2'''-(1,4,7,10-TETRAAZACYCLODODECANE-1,4,7,10-TETRYL)TETRAACETIC ACID; 2-(4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl)acetic acid
| Reported hazard statements | H315 (91.1%), H317 (17.9%), H319 (100%), H335 (71.4%) |
|---|
H315 (91.1%): Causes skin irritation [Warning Skin corrosion/irritation]
H317 (17.9%): May cause an allergic skin reaction [Warning Sensitization, Skin]
1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetic acid · CAS 60239-18-1 · C16H28N4O8. UNII 1HTE449DGZ.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: 1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetic acid