Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 85572생성일: 2026년 11월 3일
1,3-Isobenzofurandione, 3a,4,7,7a-tetrahydro-5-methyl-4-(3-methyl-2-buten-1-yl)-
5-methyl-6-(3-methyl-2-butenyl)cyclohex-4-ene-1,2-dicarboxylic anhydride · 5-Methyl-6-(3-methyl-2-butenyl)-4-cyclohexene-1,2-dicarboxylic anhydride · 3a,4,7,7a-tetrahydro-5-methyl-4-(3-methyl-2-butenyl)-3-isobenzofurandione · 2-dicarboxylic anhydride, 5-methyl-6-(3-methyl-2-butenyl]-4-Cyclohexene-1 · 3-Isobenzofurandione, 3a,4,7,7a-tetrahydro-5-methyl-4-(3-methyl-2-butenyl)-1 · 1,3-Isobenzofurandione, 3a,4,7,7a-tetrahydro-5-methyl-4-(3-methyl-2-butenyl)- · 1,3-Isobenzofurandione, 3a,4,7,7a-tetrahydro-5-methyl-4-(3-methyl-2-buten-1-yl)-
https://huagongshe.com/ko/chemical/85572
식별자 및 물리적 특성
| CAS No. | 16726-03-7 |
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| 분자식 | C14H18O3 |
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| 평균 분자량 | 234.29 g/mol |
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| 단동위원소 질량 | 234.12559443 g/mol |
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| SMILES | CC(C)=CCC1C(C)=CCC2C(=O)OC(=O)C21 |
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| InChIKey | KPKSFNJCYGUOHN-UHFFFAOYSA-N |
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| PubChem CID | 85572 |
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| EC No. | 240-782-2 |
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| DTXSID | DTXSID10864711 |
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화학 및 물리적 성질
| XLogP | 2.4 |
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| 극성 표면적 | 43.4 |
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| 수소 결합 공여자 수 | 0 |
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| 수소 결합 수용자 수 | 3 |
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| 회전 가능 결합 수 | 2 |
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| 무거운 원자 수 | 17 |
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| 형식 전하 | 0 |
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| 복잡도 | 413 |
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| 끓는 점 | 143-145 °C(Press: 0.4 Torr) |
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| 밀도 | 1.082±0.06 g/cm3(Predicted) |
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| EPA | 1,3-Isobenzofurandione, 3a,4,7,7a-tetrahydro-5-methyl-4-(3-methyl-2-butenyl)- (16726-03-7) |
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안전 및 규제
| GHS 분류 | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 9 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 | 1,3-Isobenzofurandione, 3a,4,7,7a-tetrahydro-5-methyl-4-(3-methyl-2-butenyl)-: 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 | Acute Tox. 4 (100%) |
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| TSCA 등재 상태 | TSCA listed |
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