Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 166293생성일: 2026년 11월 4일
Benzenesulfonic acid, 3-[2-[2-hydroxy-3-[[(2-methylphenyl)amino]carbonyl]-1-naphthalenyl]diazenyl]-4-methoxy-, 4-nitrophenyl ester
Pigment Red 95 · UORQSRSLZXYOJT-JEIPZWNWSA-N · benzenesulfonic acid, 3-[[2-hydroxy-3-[[(2-methylphenyl)amino]carbonyl]-1-napht · nitrophenyl 3-[[2-hydroxy-3-[(2-methylphenyl)carbamoyl]-1-naphthyl]azo]-4-methoxybenzenesulphonate · 1-[[2-Methoxy-5-[(4-nitrophenoxy)sulfonyl]phenyl] azo]-3-[[(2-methylphenyl)amino]carbonyl]-2-naphthol · 3-[2-Hydroxy-3-(2-methylphenylaminocarbonyl)-1-naphthalenylazo]-4-methoxybenzenesulfonic acid 4-nitrophenyl ester · Benzenesulfonic acid, 3-[[2-hydroxy-3-[[(2-methylphenyl)amino]carbonyl]-1-naphthalenyl] azo]-4-methoxy-, 4-nitrophenyl ester
https://huagongshe.com/ko/chemical/166293
![Benzenesulfonic acid, 3-[2-[2-hydroxy-3-[[(2-methylphenyl)amino]carbonyl]-1-naphthalenyl]diazenyl]-4-methoxy-, 4-nitrophenyl ester 분자 구조식](/img/chemical/166293.png)
식별자 및 물리적 특성
| CAS No. | 61968-79-4 |
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| 분자식 | C31H24N4O8S |
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| 평균 분자량 | 612.6 g/mol |
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| 단동위원소 질량 | 612.13148491 g/mol |
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| SMILES | COc1ccc(S(=O)(=O)Oc2ccc([N+](=O)[O-])cc2)cc1N=Nc1c(O)c(C(=O)Nc2ccccc2C)cc2ccccc12 |
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| InChIKey | SECAKRZQBSFFML-UHFFFAOYSA-N |
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| PubChem CID | 166293 |
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| EC No. | 276-755-7 |
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| DTXSID | DTXSID90868156 |
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화학 및 물리적 성질
| XLogP | 7.2 |
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| 극성 표면적 | 181 |
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| 수소 결합 공여자 수 | 2 |
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| 수소 결합 수용자 수 | 10 |
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| 회전 가능 결합 수 | 8 |
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| 무거운 원자 수 | 44 |
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| 형식 전하 | 0 |
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| 복잡도 | 1,120 |
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| 끓는 점 | 801.0±65.0 °C(Predicted) |
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| 밀도 | 1.41±0.1 g/cm3(Predicted) |
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| pKa(산도 계수) | 11.98±0.70(Predicted) |
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| EPA | Benzenesulfonic acid, 3-[[2-hydroxy-3-[[(2-methylphenyl)amino]carbonyl]-1-naphthalenyl]azo]-4-methoxy-, 4-nitrophenyl ester (72639-39-5) |
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안전 및 규제
| GHS 분류 | This chemical does not meet GHS hazard criteria for 100% (42 of 42) of all reports.Not ClassifiedAggregated GHS information provided per 42 reports by companies from 2 notifications to the ECHA C&L Inventory.This chemical does not meet GHS hazard criteria for 100% (37 of 37) of all reports.Aggregated GHS information provided per 37 reports by companies from 1 notifications to the ECHA C&L Inventory. |
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| 규제 정보 | Chemical: Benzenesulfonic acid, 3-[[2-hydroxy-3-[[(2-methylphenyl)amino]carbonyl]-1-naphthalenyl]azo]-4-methoxy-, 4-nitrophenyl ester |
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| 기타 안전 정보 | IMAP assessments - Benzenesulfonic acid, 3-[[2-hydroxy-3-[[(2-methylphenyl)amino]carbonyl]-1-naphthalenyl]azo]-4-methoxy-, 4-nitrophenyl ester: Human health tier I assessment |
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| Hazard Classes and Categories | Not Classified |
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| TSCA 등재 상태 | TSCA listed |
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