기본 정보
- 표준 SMILES
CCCCCCCCCCCCOP(=O)(O)O- InChIKey
TVACALAUIQMRDF-UHFFFAOYSA-N- 분자식
- C12H27O4P
- 평균 분자량
- 266.31 g/mol
- 단동위원소 질량
- 266.16469597
개요
The CIR Expert Panel concluded the following 28 alkyl phosphates are safe in the present practices of use and concentration in cosmetics when formulated to be non-irritating...Lauryl Phosphate...
이름 및 식별자
- 우선 이름
- Lauryl Phosphate
- IUPAC
- dodecyl dihydrogen phosphate
- 영어명
- Dodecyl dihydrogen phosphate
- 분자식
- C12H27O4P
- 분자량
- 266.31
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
2627-35-2- PubChem CID
- 75816
- DTXSID
DTXSID70880492- ChEMBL
CHEMBL187711- UNII
- 0K08L8GE2H
- EC Number
- 220-095-4
- Nikkaji
- J192.141J
물성
구조 계산 물성
- XLogP
- 4
- 극성 표면적
- 66.8 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 12
- 무거운 원자 수
- 17
- 형식 전하
- 0
- 복잡도
- 203
실험 및 물리화학적 성질
Cosmetics
Cosmetic ingredients (Lauryl Phosphate) -> CIR (Cosmetic Ingredient Review)
Emulsifying
물리화학적 성질
- 녹는점
- 39 · 39-45°C
- 끓는 점
- 385.5 · 385.5±25.0 °C(Predicted)
- 밀도
- 1.056 · 1.056±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 1.95 · 1.95±0.10(Predicted)
- 물리적 상태
- 흰색 내지 회백색 고체.
- 수용성
- 물에 불용성.
- BRN
- 1710518 · 1710518
- InChI
- 1S/C12H27O4P/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h2-12H2,1H3,(H2,13,14,15)
- InChIKey
- TVACALAUIQMRDF-UHFFFAOYSA-N
- SMILES
- CCCCCCCCCCCCOP(O)(O)=O
- EPA
- Monolauryl phosphate (2627-35-2)
안전 및 규제
GHS 분류
GHS Classification
Danger
H314 (14.3%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P261, P264, P264+P265, P271, P273, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 7 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Phosphoric acid, monododecyl ester
Phosphoric acid, monododecyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
독성 정보
Toxicity Summary
The CIR Expert Panel concluded the following 28 alkyl phosphates are safe in the present practices of use and concentration in cosmetics when formulated to be non-irritating...Lauryl Phosphate...
Safe for use in cosmetics, with qualifications
안전 데이터
- wgk
- WGK 2
- tsca
- TSCA listed
- ridadr
- 3261
- risk_code
- 36/37/38-43-41-37/38
- hazard_code
- Xi
- safety_code
- 26-36/37/39-45
- Hazard Classifications
- Eye Dam. 1Skin Irrit. 2Skin Sens. 1STOT SE 3
- 스토리지 클래스
- 10 - Combustible liquids
화학 및 산업
용도 및 제조
응용 분야
용도mono-n-Dodecyl phosphate is a lysophosphatidic acid (LPA) receptor ligand which serves as a specific agonist at EDG-4 (LPA2) (EC50=700 nM) and antagonist at EDG-7
공급사32 곳
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