Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
2,6-다이아이소프로필나프탈렌
2,6-다이아이소프로필나프탈렌 · 2,6-DIPN · 2,6-DIISOPRYLNAPHTHALENE · 2,6-diisopropyl naphtalene · 2,6-DIISOPROPYLNAPHTHALENE · Naphthalene, 2,6-diisopropyl- · 2,6-Diisopropylnaphthalene>2,6-Diisopropylnaphthalene,99% · 2,6-Di(propan-2-yl)naphthalene
식별자 및 물리적 특성
| CAS No. | 24157-81-1 |
|---|---|
| 분자식 | C16H20 |
| 평균 분자량 | 212.33 g/mol |
| 단동위원소 질량 | 212.15650064 g/mol |
| SMILES | CC(C)c1ccc2cc(C(C)C)ccc2c1 |
| InChIKey | GWLLTEXUIOFAFE-UHFFFAOYSA-N |
| PubChem CID | 32241 |
| ChEMBL | CHEMBL3182870 |
| ChEBI | CHEBI:145669 |
| EC No. | 246-045-1 |
| DTXSID | DTXSID7035272 |
| 현지명 | 2,6-다이아이소프로필나프탈렌 |
화학 및 물리적 성질
| XLogP | 5.8 |
|---|---|
| 극성 표면적 | 0 |
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 0 |
| 회전 가능 결합 수 | 2 |
| 무거운 원자 수 | 16 |
| 형식 전하 | 0 |
| 복잡도 | 192 |
| Kovats Retention Index | 17041716.817281735.517271733172522142242 |
| 녹는점 | 67-70 °C |
| 끓는 점 | 279.3 °C |
| 밀도 | 0.9560 (estimate) |
| 증기압 | 0.08Pa at 25℃ |
| 굴절률 | 1.5774 (estimate) |
| 인화점 | 140 °C |
| 저장 조건 | Store at room temperature |
| 용해도 | 아세토니트릴(약간 용해됨), 클로로포름(약간 용해됨), 메탄올 |
| 물리적 상태 | powder to crystal |
| 색상 | 흰색에서 거의 흰색 |
| 비중 | 0.968 |
| 용해도 | 1mg/L at 25℃ |
| 헨리 상수 | 1.3×10-2 mol/(m3Pa) at 25℃, Schröder et al. (2013) |
| InChI | 1S/C16H20/c1-11(2)13-5-7-16-10-14(12(3)4)6-8-15(16)9-13/h5-12H,1-4H3 |
| InChIKey | GWLLTEXUIOFAFE-UHFFFAOYSA-N |
| SMILES | CC(C)c1ccc2cc(ccc2c1)C(C)C |
| LogP(분배 계수) | 6.5 at 25℃ |
| EPA | 2,6-Diisopropylnaphthalene (24157-81-1) |
화학적 성질
beige crystalline platelets
안전 및 규제
| GHS 분류 | This chemical does not meet GHS hazard criteria for 6.5% (3 of 46) of reports.WarningH302 (84.8%): Harmful if swallowed [Warning Acute toxicity, oral]H400 (84.8%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]H410 (93.5%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 46 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Reported as not meeting GHS hazard criteria per 3 of 46 reports by companies.There are 3 notifications provided by 43 of 46 reports by companies with hazard statement code(s).Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| 규제 정보 | Status: Active Update: 19-02-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/24684 |
| Hazard Classes and Categories | Acute Tox. 4 (84.8%)Aquatic Acute 1 (84.8%)Aquatic Chronic 1 (93.5%) |
| 수질 위해 등급(WGK) | WGK 3 |
| TSCA 등재 상태 | TSCA listed |
| 운송 번호(UN) | 3077 |
| 관세 코드 | 29029090 |
| 위험 문구(R) | 22-50/53 |
| 위험 표시 | Xn,N |
| 안전 문구(S) | 24/25-61-60 |
| 포장분류 | III |
| 위험 등급 | 9Acute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1 |
| 저장 분류 | 11 - Combustible Solids |
용도
일반 설명
Clear yellowish brown liquid with a faint sweet odor.