2-(3,6-二羟基-2,4,5,7-四溴氧原-9-基)-苯甲酸(CAS 15086-94-9):分子式 C20H8Br4O5、分子量 647.9。
| CAS号 | 15086-94-9 |
|---|---|
| 分子式 | C20H8Br4O5 |
| 分子量 | 647.9 |
| LogP | 6.2 |
2-(3,6-二羟基-2,4,5,7-四溴氧原-9-基)-苯甲酸 是一种化工化合物,登记 CAS 号为 15086-94-9,分子式 C20H8Br4O5(分子量 647.9)。
登记 CAS 号:15086-94-9
其分子式 C20H8Br4O5 由 20 个碳、8 个氢、4 个溴、5 个氧 组成。
别名/同义词:2-(3,6-二羟基-2,4,5,7-四溴氧原-9-基)-苯甲酸 · 2-(3,6-dihydroxy-2,4,5,7-tetrabromoxanthen-9-yl)-benzoic acid
2-(3,6-二羟基-2,4,5,7-四溴氧原-9-基)-苯甲酸 的 CAS 登记号为 15086-94-9。
分子式 C20H8Br4O5,分子量 647.9。
别名/同义词:2-(3,6-二羟基-2,4,5,7-四溴氧原-9-基)-苯甲酸、2-(3,6-dihydroxy-2,4,5,7-tetrabromoxanthen-9-yl)-benzoic acid。
2-(3,6-二羟基-2,4,5,7-四溴氧原-9-基)-苯甲酸(CAS 15086-94-9)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 15086-94-9 |
|---|---|
| PubChem CID | 27020 |
| Molecular formula | C20H8Br4O5 |
| IUPAC name | 2',4',5',7'-tetrabromo-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one |
| UNII (FDA) | 2730CL9N7C |
| Molecular Weight | 647.9 |
|---|---|
| XLogP3 | 6.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 0 |
| Exact Mass | 647.70642 |
| Monoisotopic Mass | 643.71052 |
| Topological Polar Surface Area | 76 |
| Heavy Atom Count | 29 |
| Color Additive Status | 74.1321 |
|---|---|
| Color Additive Status | 74.2321 |
| Color Additive Status | 82.1321 |
15086-94-9; 2',4',5',7'-Tetrabromofluorescein; C.I. Solvent Red 43; DTXSID3044590; C.I. 45380:2; 3,6-Dihydroxy-2,4,5,7-tetrabromospiro(xanthene-9,3'-phthalide); CI 45380:2; NSC-244436; 2',4',5',7'-tetrabromo-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one; Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 2',4',5',7'-tetrabromo-3',6'-dihydroxy-; DTXCID1024590; 2',4',5',7'-tetrabromo-3',6'-dihydroxy-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one; Spiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one, 2',4',5',7'-tetrabromo-3',6'-dihydroxy-; 2',4',5',7'-TETRABROMO-3',6'-DIHYDROXY-3H-SPIRO(2-BENZOFURAN-1,9'-XANTHEN)-3-ONE; 2',4',5',7'-tetrabromo-3',6'-dihydroxyspiro(2-benzofuran-3,9'-xanthene)-1-one; RefChem:1058590
| Regulatory & Food Contact | FDA Regulatory Status of Color Additives: Drugs, Cosmetics CIR / INCI: Cosmetics ingredient -> Colorant CIR / INCI: Hair dyeing |
|---|---|
| GHS notification summary | 74.5% (123 / 165) |
| GHS notification summary | 74.5% (123 / 165) |
|---|---|
| Reported hazard statements | H302 (24.2%) |
This chemical does not meet GHS hazard criteria for 74.5% (123 of 165) of all reports.
H302 (24.2%): Harmful if swallowed [Warning Acute toxicity, oral]
2-(3,6-dihydroxy-2,4,5,7-tetrabromoxanthen-9-yl)-benzoic acid · CAS 15086-94-9 · C20H8Br4O5. UNII 2730CL9N7C. Color Additive Status: 74.1321; Color Additive Status: 74.2321; Color Additive Status: 82.1321.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: 2-(3,6-dihydroxy-2,4,5,7-tetrabromoxanthen-9-yl)-benzoic acid