Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 87935생성일: 2026년 10월 27일
2-부틸-6-(부틸아미노)-1H-벤즈(디)이소퀴놀INE-1,3(2H)-디온
2-부틸-6-(부틸아미노)-1H-벤즈(디)이소퀴놀INE-1,3(2H)-디온 · 2-뷰틸-6-(뷰틸아미노)-1H-벤즈(디)아이소퀴놀INE-1,3(2H)-디온 · 2-뷰틸-6-(뷰틸아미노)-1H-벤즈(디)아이소퀴놀린-1,3(2H)-디온 · 용매황색43 · DFSB-K 43 · YELLOW GG · C.I.561930 · SOLVENT YELLOW 43
https://huagongshe.com/ko/chemical/87935
식별자 및 물리적 특성
| CAS No. | 19125-99-6 |
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| 분자식 | C20H24N2O2 |
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| 평균 분자량 | 324.4 g/mol |
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| 단동위원소 질량 | 324.18377801 g/mol |
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| SMILES | CCCCNc1ccc2c3c(cccc13)C(=O)N(CCCC)C2=O |
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| InChIKey | DXWHZJXKTHGHQF-UHFFFAOYSA-N |
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| PubChem CID | 87935 |
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| ChEMBL | CHEMBL1472131 |
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| EC No. | 242-828-7 |
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| DTXSID | DTXSID3051830 |
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| 현지명 | 2-부틸-6-(부틸아미노)-1H-벤즈(디)이소퀴놀INE-1,3(2H)-디온 |
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화학 및 물리적 성질
| XLogP | 4.6 |
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| 극성 표면적 | 49.4 |
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| 수소 결합 공여자 수 | 1 |
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| 수소 결합 수용자 수 | 3 |
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| 회전 가능 결합 수 | 7 |
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| 무거운 원자 수 | 24 |
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| 형식 전하 | 0 |
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| 복잡도 | 465 |
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| 용해도 | 2.1 [ug/mL] (The mean of the results at pH 7.4) |
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| 녹는점 | 126-127℃ |
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| 끓는 점 | 500.4±33.0 °C(Predicted) |
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| 밀도 | 1.174 |
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| pKa(산도 계수) | 2.66±0.20(Predicted) |
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| 용해도 | 50.7μg/L at 28℃ |
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| LogP(분배 계수) | 4.643 at 25℃ |
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| EPA | 1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-butyl-6-(butylamino)- (19125-99-6) |
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안전 및 규제
| GHS 분류 | This chemical does not meet GHS hazard criteria for 69.5% (41 of 59) of all reports.H413 (22%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]P273, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 59 reports by companies from 3 notifications to the ECHA C&L Inventory. |
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| 규제 정보 | Chemical: 1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-butyl-6-(butylamino)-REACH registered substance: 2-butyl-6-(butylamino)-1H-benz[de]isoquinoline-1,3(2H)-dione (EC: 242-828-7)1H-Benzdeisoquinoline-1,3(2H)-dione, 2-butyl-6-(butylamino)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
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| Hazard Classes and Categories | Aquatic Chronic 4 (22%) |
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| TSCA 등재 상태 | TSCA listed |
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| 기존화학 물질 | KE-04231 |
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