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Pigment Yellow 147

标识与物理属性
| CAS No. | 4118-16-5 |
|---|---|
| 分子式 | C37H21N5O4 |
| 平均分子量 | 599.6 g/mol |
| 单同位素质量 | 599.15935415 g/mol |
| SMILES | O=C1c2ccccc2C(=O)c2c(Nc3nc(Nc4cccc5c4C(=O)c4ccccc4C5=O)nc(-c4ccccc4)n3)cccc21 |
| InChIKey | MVIFQPPFCHUSIH-UHFFFAOYSA-N |
| PubChem CID | 77767 |
| EC No. | 223-912-2 |
| DTXSID | DTXSID6052083 |
化学与物理性质
| XLogP | 8.4 |
|---|---|
| 极性表面积 | 131 |
| 氢键供体 | 2 |
| 氢键受体 | 9 |
| 可旋转键 | 5 |
| 重原子 | 46 |
| 形式电荷 | 0 |
| 复杂度 | 1,110 |
| Food Contact Substances | FCS -> FDA Cumulative Estimated Daily Intake (CEDI)FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR |
| Physical Description | CBI |
安全与法规
| GHS 分类 | This chemical does not meet GHS hazard criteria for 100% (2202 of 2202) of all reports.Not ClassifiedAggregated GHS information provided per 2202 reports by companies from 2 notifications to the ECHA C&L Inventory. |
|---|---|
| 法规信息 | Chemical: 9,10-Anthracenedione, 1,1'-[(6-phenyl-1,3,5-triazine-2,4-diyl)diimino]bis-9,10-Anthracenedione, 1,1'-[(6-phenyl-1,3,5-triazine-2,4-diyl)diimino]bis- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 9,10-Anthracenedione, 1,1'-[(6-phenyl-1,3,5-triazine-2,4-diyl)diimino]bis- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)REACH registered substance: 1,1'-[(6-phenyl-1,3,5-triazine-2,4-diyl)diimino]bisanthraquinone (EC: 223-912-2)9,10-Anthracenedione, 1,1'-[(6-phenyl-1,3,5-triazine-2,4-diyl)diimino]bis-: Does not have an individual approval but may be used under an appropriate group standard |
| Hazard Classes and Categories | Not Classified |