식별자 및 물리적 특성
| CAS No. | 67953-19-9 |
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| 분자식 | C16H28O4 |
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| 평균 분자량 | 284.39 g/mol |
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| 단동위원소 질량 | 284.19875937 g/mol |
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| SMILES | CC(C)CC(C)OC(=O)C=CC(=O)OC(C)CC(C)C |
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| InChIKey | NZQQFMVULBBDSP-UHFFFAOYSA-N |
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| PubChem CID | 7760 |
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| EC No. | 267-946-6 |
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| DTXSID | DTXSID30859184 |
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화학 및 물리적 성질
| XLogP | 4.5 |
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| 극성 표면적 | 52.6 |
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| 수소 결합 공여자 수 | 0 |
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| 수소 결합 수용자 수 | 4 |
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| 회전 가능 결합 수 | 10 |
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| 무거운 원자 수 | 20 |
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| 형식 전하 | 0 |
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| 복잡도 | 299 |
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| Physical Description | Liquid |
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안전 및 규제
| GHS 분류 | This chemical does not meet GHS hazard criteria for 100% (121 of 121) of all reports.Not ClassifiedAggregated GHS information provided per 121 reports by companies from 1 notifications to the ECHA C&L Inventory. |
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| 규제 정보 | 2-Butenedioic acid, 1,4-bis(1,3-dimethylbutyl) ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Butenedioic acid, 1,4-bis(1,3-dimethylbutyl) ester 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: Bis(1,3-dimethylbutyl) 2-butenedioate (EC: 267-946-6) |
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| Hazard Classes and Categories | Not Classified |
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