식별자 및 물리적 특성
| CAS No. | 372-29-2 |
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| 분자식 | C6H8F3NO2 |
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| 평균 분자량 | 183.13 g/mol |
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| SMILES | CCOC(=O)/C=C(\N)C(F)(F)F |
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| InChIKey | NXVKRKUGIINGHD-ARJAWSKDSA-N |
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| PubChem CID | 5702529 |
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| EC No. | 609-360-9 |
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화학 및 물리적 성질
| XLogP | 1.5 |
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| 극성 표면적 | 52.3 |
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| 수소 결합 공여자 수 | 1 |
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| 수소 결합 수용자 수 | 6 |
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| 회전 가능 결합 수 | 3 |
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| 무거운 원자 수 | 12 |
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| 형식 전하 | 0 |
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| 복잡도 | 197 |
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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 1.7% (1 of 59) of reports.DangerH302 (88.1%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 59 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| 규제 정보 | 2-Butenoic acid, 3-amino-4,4,4-trifluoro-, ethyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Butenoic acid, 3-amino-4,4,4-trifluoro-, ethyl 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)PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.2-Butenoic acid, 3-amino-4,4,4-trifluoro-, ethyl ester: Does not have an individual approval but may be used under an appropriate group standard |
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| Hazard Classes and Categories | Acute Tox. 4 (88.1%)Acute Tox. 4 (100%) |
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