Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
1,2,3- 프로판, 트리프로파노네이트
1,2,3-프로판,트리프로파노네이트 · FEMA 3286 · ipropionin · tri-propioni · TRIPROPIONIN · Tripropionine · Propionin, tri- · Tripropionin,97%
식별자 및 물리적 특성
| CAS No. | 139-45-7 |
|---|---|
| 분자식 | C12H20O6 |
| 평균 분자량 | 260.28 g/mol |
| 단동위원소 질량 | 260.12598835 g/mol |
| SMILES | CCC(=O)OCC(COC(=O)CC)OC(=O)CC |
| InChIKey | YZWRNSARCRTXDS-UHFFFAOYSA-N |
| PubChem CID | 8763 |
| ChEBI | CHEBI:88153 |
| EC No. | 205-365-1 |
| DTXSID | DTXSID8051702 |
| 현지명 | 1,2,3- 프로판, 트리프로파노네이트 |
화학 및 물리적 성질
| XLogP | 1.7 |
|---|---|
| 극성 표면적 | 78.9 |
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 6 |
| 회전 가능 결합 수 | 11 |
| 무거운 원자 수 | 18 |
| 형식 전하 | 0 |
| 복잡도 | 266 |
| 밀도 | 1.065-1.082 |
| 용해도 | 3.07 mg/mL at 37 °Cslightly soluble in watersoluble in organic solvents, oilssoluble (in ethanol) |
| 끓는 점 | 175.00 to 176.00 °C. @ 20.00 mm Hg175 °C (20 mm Hg)175-176 °C20 mm Hg(lit.) |
| 굴절률 | 1.428-1.435n20/D 1.434(lit.) |
| Physical Description | colourless to pale yellow liquid with practically no odour |
| Kovats Retention Index | 15651567156915711546 |
| Collision Cross Section | 161.2 Ų [M+Na]+ [CCS Type: DTBuffer gas: N2Ionization: ESI+Dataset: TOXCASTSource Identifier: DTXSID8051702] |
| 증기 밀도 | 8.95 (vs air) |
| FEMA | 3286 | GLYCERYL TRIPROPANOATE |
| 인화점 | >230 °F |
| 물리적 상태 | 액체 |
| 색상 | 무색의 |
| 냄새 | 100.00%에서. 기름진 지방 과일 화학 물질 |
| 향취 유형 | 기름진 냄새 |
| 생물학적 소스 | synthetic |
| 폭발한계 | 0.8%, 186°F |
| 용해도 | 0.23g/L(25℃) |
| JECFA Number | 921 |
| InChI | 1S/C12H20O6/c1-4-10(13)16-7-9(18-12(15)6-3)8-17-11(14)5-2/h9H,4-8H2,1-3H3 |
| InChIKey | YZWRNSARCRTXDS-UHFFFAOYSA-N |
| SMILES | CCC(=O)OCC(COC(=O)CC)OC(=O)CC |
| LogP(분배 계수) | 1.36 |
| EPA | 1,2,3-Propanetriol, tripropanoate (139-45-7) |
화학적 성질
Tripropionin is insoluble in water and soluble in ethyl alcohol, ether, and chloroform.
안전 및 규제
| GHS 분류 | This chemical does not meet GHS hazard criteria for 100% (90 of 90) of all reports.Not ClassifiedReported as not meeting GHS hazard criteria by 90 of 90 companies. For more detailed information, please visit ECHA C&L website.Aggregated GHS information provided per 90 reports by companies from 1 notifications to the ECHA C&L Inventory.Reported as not meeting GHS hazard criteria per 90 of 90 reports by companies.There are 0 notifications provided by 0 of 90 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 | Chemical: 1,2,3-Propanetriol, tripropanoateCommission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)1,2,3-Propanetriol, tripropanoate: Does not have an individual approval but may be used under an appropriate group standard |
| Hazard Classes and Categories | Not Classified |
| 수질 위해 등급(WGK) | 2 |
| TSCA 등재 상태 | TSCA listed |
| RTECS 번호 | YK6000000 |
| 독성 | mouse,LD50,intravenous,840mg/kg (840mg/kg),LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATIONBEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY),Acta Physiologica Scandinavica. Vol. 40, Pg. 338, 1957. |
| 관세 코드 | 29159000 |
| 안전 문구(S) | 24/25 |
| 기존화학 물질 | KE-29333 |
| 자연 발화 온도 | 790 °F |
| 저장 분류 | 10 - Combustible liquids |
용도
용도
Plasticizer