Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
Isononanol
7-Methyloctanol · 7-methyl-1-octano · 7-METHYL-1-OCTANOL · 1-Octanol, 7-methyl- · 7-Methyl-1-octyl Alcohol · 7-Methyloctanol (Isononyl Alcohol) · 7-Methyl-1-octyl Alcohol (unlabelled) · 7-METHYL-1-OCTANOL ISO 9001：2015 REACH
식별자 및 물리적 특성
| CAS No. | 2430-22-0 |
|---|---|
| 분자식 | C9H20O |
| 평균 분자량 | 144.25 g/mol |
| 단동위원소 질량 | 144.15141526 g/mol |
| SMILES | CC(C)CCCCCCO |
| InChIKey | QDTDKYHPHANITQ-UHFFFAOYSA-N |
| PubChem CID | 17072 |
| ChEBI | CHEBI:188348 |
| EC No. | 248-471-3 |
| DTXSID | DTXSID2058675 |
화학 및 물리적 성질
| XLogP | 3.5 |
|---|---|
| 극성 표면적 | 20.2 |
| 수소 결합 공여자 수 | 1 |
| 수소 결합 수용자 수 | 1 |
| 회전 가능 결합 수 | 6 |
| 무거운 원자 수 | 10 |
| 형식 전하 | 0 |
| 복잡도 | 59.7 |
| SpringerMaterials Properties | Density |
| 향료 | Fragrance Ingredient (Isononyl alcohol (isomer unspecified)) -> IFRA transparency List |
| Physical Description | Liquid |
| 녹는점 | 64.5°C |
| 끓는 점 | 192.9°C (estimate) |
| 밀도 | 0.8260 |
| 굴절률 | 1.4316 |
| 저장 조건 | Refrigerator |
| 용해도 | 에 용해됨클로로포름, 메탄올 (약간 용해됨) |
| 물리적 상태 | 기름 |
| pKa(산도 계수) | 15.20±0.10(Predicted) |
| 색상 | 무색 |
| 헨리 상수 | 4.3×10-2 mol/(m3Pa) at 25℃, Yaws (2003) |
| LogP(분배 계수) | 3.230 (est) |
| EPA | 1-Octanol, 7-methyl- (2430-22-0) |
화학적 성질
7-METHYL-1-OCTANOL is Colourless Oil
안전 및 규제
| GHS 분류 | This chemical does not meet GHS hazard criteria for 0.2% (1 of 427) of reports.DangerH315 (77.3%): Causes skin irritation [Warning Skin corrosion/irritation]P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P305+P354+P338, P317, P321, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 427 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| 규제 정보 | Chemical: 1-Octanol, 7-methyl-Chemical: IsononanolIsononanol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Isononanol 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)Status: Active Update: 15-12-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/13404Isononanol: Does not have an individual approval but may be used under an appropriate group standard |
| 기타 안전 정보 | Evaluation - Chemicals that are unlikely to require further regulation to manage risks to environment |
| Hazard Classes and Categories | Skin Irrit. 2 (77.3%) |
| 기존화학 물질 | KE-24540 |
용도
용도
7-METHYL-1-OCTANOL is used in the synthesis of the sex pheromone of Elater ferrugineus.