Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 77288생성일: 2026년 11월 2일
에틸N-옥틸황화물
에틸N-옥틸황화물 · Octylethyl sulfide · 1-(ethylthio)-octan · Ethyl octyl sulfide · ethyl octyl sulphide · ETHYL N-OCTYL SULFIDE · 1-ethylsulfanyloctane · Octane, 1-(ethylthio)-
https://huagongshe.com/ko/chemical/77288
식별자 및 물리적 특성
| CAS No. | 3698-94-0 |
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| 분자식 | C10H22S |
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| 평균 분자량 | 174.35 g/mol |
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| 단동위원소 질량 | 174.14422188 g/mol |
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| SMILES | CCCCCCCCSCC |
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| InChIKey | WAITXWGCJQLPGH-UHFFFAOYSA-N |
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| PubChem CID | 77288 |
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| ChEMBL | CHEMBL3186809 |
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| EC No. | 653-186-6 |
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| DTXSID | DTXSID4044662 |
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| 현지명 | 에틸N-옥틸황화물 |
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화학 및 물리적 성질
| XLogP | 4.7 |
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| 극성 표면적 | 25.3 |
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| 수소 결합 공여자 수 | 0 |
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| 수소 결합 수용자 수 | 1 |
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| 회전 가능 결합 수 | 8 |
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| 무거운 원자 수 | 11 |
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| 형식 전하 | 0 |
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| 복잡도 | 61.9 |
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| Physical Description | Liquid |
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| 녹는점 | -53.83°C (estimate) |
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| 끓는 점 | 215.37°C (estimate) |
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| 밀도 | 0.8410 |
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| 굴절률 | 1.4465 (estimate) |
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| 헨리 상수 | 1.6×10-3 mol/(m3Pa) at 25℃, Yaws et al. (2003) |
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| EPA | Octane, 1-(ethylthio)- (3698-94-0) |
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안전 및 규제
| GHS 분류 | WarningH400 (17%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]P273, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 47 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| 규제 정보 | Chemical: Octane, 1-(ethylthio)-Octane, 1-(ethylthio)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Octane, 1-(ethylthio)- 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)PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance. |
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| Hazard Classes and Categories | Aquatic Acute 1 (17%) |
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| TSCA 등재 상태 | TSCA listed |
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