Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
2,4-Dimethylbenzyl alcohol
RARECHEM AL BD 0048 · 2,4-Dimethylbenzyl alcohol · 2,4-Dimethylbenzenemethanol · 2,4-DIMETHYLPHENYL METHANOL · 2,4-DimethylbenzylAlcohol>Benzyl alcohol, 2,4-dimethyl- · 2,4-Dimethylbenzyl alcohol,90% · Benzenemethanol, 2,4-dimethyl-
식별자 및 물리적 특성
| CAS No. | 16308-92-2 |
|---|---|
| 분자식 | C9H12O |
| 평균 분자량 | 136.19 g/mol |
| 단동위원소 질량 | 136.088815 g/mol |
| SMILES | Cc1ccc(CO)c(C)c1 |
| InChIKey | QUIMJTKRVOBTQN-UHFFFAOYSA-N |
| PubChem CID | 27809 |
| ChEBI | CHEBI:231516 |
| EC No. | 240-393-8 |
| DTXSID | DTXSID90167510 |
화학 및 물리적 성질
| XLogP | 1.8 |
|---|---|
| 극성 표면적 | 20.2 |
| 수소 결합 공여자 수 | 1 |
| 수소 결합 수용자 수 | 1 |
| 회전 가능 결합 수 | 1 |
| 무거운 원자 수 | 10 |
| 형식 전하 | 0 |
| 복잡도 | 101 |
| 녹는점 | 22°C |
| 끓는 점 | 120 °C13 mm Hg(lit.) |
| 밀도 | 1.0310 |
| 굴절률 | n20/D 1.534(lit.) |
| 인화점 | >230 °F |
| 저장 조건 | Sealed in dry,Room Temperature |
| 물리적 상태 | 녹은 후에 액체 |
| pKa(산도 계수) | 14.50±0.10(Predicted) |
| 색상 | 무색투명~미황색 |
| BRN | 1859679 |
| LogP(분배 계수) | 2.049 (est) |
화학적 성질
clear colorless to slightly yellow
안전 및 규제
| GHS 분류 | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| 규제 정보 | Chemical: Benzenemethanol, 2,4-dimethyl-Benzenemethanol, 2,4-dimethyl-: 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 (100%) |
| 수질 위해 등급(WGK) | 3 |
| 관세 코드 | 29062990 |
| 안전 문구(S) | 24/25 |
용도
용도
2,4-Dimethylbenzyl alcohol is an aryl alcohol that can be used in the preparation of aldehydes, ketones and esters by oxidation reactions. It is also used in the preparation of thermoplastic polymers.