Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
소듐카프레이트
소듐카프레이트 · SODIUM CAPRATE · SODIUM DECANOATE · SODIUM CAPRINATE · SODIUM N-DECANOATE · capric acid sodium · sodiumdecanoicacid · Sodium Decanoate >Capric acid sodium sal
식별자 및 물리적 특성
| CAS No. | 1002-62-6 |
|---|---|
| 분자식 | C10H19NaO2 |
| 평균 분자량 | 194.25 g/mol |
| 단동위원소 질량 | 194.12827413 g/mol |
| SMILES | CCCCCCCCCC(=O)[O-].[Na+] |
| InChIKey | FIWQZURFGYXCEO-UHFFFAOYSA-M |
| PubChem CID | 4457968 |
| EC No. | 213-688-4 |
| DTXSID | DTXSID0027351 |
| 현지명 | 소듐카프레이트 |
화학 및 물리적 성질
| 극성 표면적 | 40.1 |
|---|---|
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 2 |
| 회전 가능 결합 수 | 8 |
| 무거운 원자 수 | 13 |
| 형식 전하 | 0 |
| 복잡도 | 115 |
| 화장품 | Cosmetic ingredients (Sodium Caprate) -> CIR (Cosmetic Ingredient Review) |
| 식품 첨가물 | ANTICAKING AGENT OR FREE-FLOW AGENT, EMULSIFIER OR EMULSIFIER SALT, LUBRICANT OR RELEASE AGENT -> FDA Substance added to food |
| 녹는점 | ~240 °C (dec.) |
| 저장 조건 | 2-8°C |
| 용해도 | H2O: 0.1 g/mL, 투명, 무색 |
| 물리적 상태 | powder to crystal |
| 색상 | 흰색에서 밝은 노란색 |
| 생물학적 소스 | natural (organic) |
| 용해도 | 물에 거의 녹지 않음 |
| BRN | 3572742 |
| 화장품 원료 기능 | 계면활성제 - 세정세척제 |
| InChI | InChI=1S/C10H20O2.Na/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)/q+1/p-1 |
| InChIKey | FIWQZURFGYXCEO-UHFFFAOYSA-M |
| SMILES | C(CCC([O-])=O)CCCCCC.[Na+] |
| LogP(분배 계수) | 3.965 (est) |
| EPA | Sodium decanoate (1002-62-6) |
안전 및 규제
| GHS 분류 | This chemical does not meet GHS hazard criteria for 5.3% (2 of 38) of reports.H412 (94.7%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P273, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 38 reports by companies from 3 notifications to the ECHA C&L Inventory. |
|---|---|
| 규제 정보 | Chemical: Decanoic acid, sodium saltDecanoic acid, sodium salt: Does not have an individual approval but may be used under an appropriate group standard |
| 기타 안전 정보 | IMAP assessments - Decanoic acid, sodium salt: Environment tier I assessment |
| EPA Safer Chemical | Chemical: Sodium decanoate |
| Hazard Classes and Categories | Aquatic Chronic 3 (94.7%) |
| 독성 요약 | The CIR Expert Panel concluded that the following ingredients are safe in the present practices of use andconcentration described in the safety assessment when formulated to be non-irritating and non-sensitizing, which may be based on a QRA...Sodium Caprate...Safe for use in cosmetics, with qualifications |
| 수질 위해 등급(WGK) | 3 |
| TSCA 등재 상태 | TSCA listed |
| RTECS 번호 | HE0200000 |
| 관세 코드 | 2915.90.5050 |
| 안전 문구(S) | 22-24/25 |
| 기존화학 물질 | KE-09481 |
| 저장 분류 | 11 - Combustible Solids |
용도
개요
Sodium decanoate has amphiphilic character and can form micelles and liquid crystalline phases in aqueous solution. In a chemical model system, it has been used in 13C NMR studies of the addition of hydrophilic and hydrophobic molecules to the 1-monooleoyl glycerol/water system, to elucidate the transport of biologically active molecules.
용도
Sodium Caprate is the sodium salt of capric acid. It functions as a binder, emulsifier, and anticaking agent.