Hexadecyl phosphate (HCID 19059)

概要

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...Cetyl Phosphate...

名称と識別子

優先名称: Hexadecyl phosphate
IUPAC: hexadecyl dihydrogen phosphate
現地名: りん酸ヘキサデシル
英語名: AMPHISOL A
分子式: C16H35O4P
分子量: 322.42

名称と別名

Hexadecyl dihydrogen phosphate3539-43-3Hexadecyl phosphateCETYL PHOSPHATE1-Hexadecanol, dihydrogen phosphateHostaphat CC 100VT07D6X67OMACKESTER CEPCRODAFOS MCADTXSID1045039RefChem:786052DTXCID9025039

名称をさらに表示

りん酸ヘキサデシルりん酸セチル1-ヘキサデカノールりん酸1-ヘキサデカノール二水素ホスファートりん酸二水素ヘキサデシル(ヘキサデシルオキシ)ホスホン酸Cetyl Phosphate (AMPHISOL A)cetylphosphatehexadecylphosphatecethylphosphoric esterMONO-N-HEXADECYLPHOSPHATEHexadecyldihydrogenphosphatZUVCYFMOHFTGDM-UHFFFAOYSA-NPHOSPHORICMONOHEXADECYL ESTER

222-581-1AMPHISOL Amonocetyl phosphate1-Hexadecanol,1-(dihydrogen phosphate)cetyl dihydrogen phosphateUNII-VT07D6X67OPhosphoric acid monohexadecyl esterEINECS 222-581-1

データベース識別子

CAS: 3539-43-3
PubChem CID: 19059
DTXSID: DTXSID1045039
ChEMBL: CHEMBL479322
UNII: VT07D6X67O
EC Number: 222-581-1
Nikkaji: J216.184B

物性

構造計算による物性

XLogP: 6.2
極性表面積: 66.8 Å²
水素結合供与体数: 2
水素結合受容体数: 4
回転可能結合数: 16
重原子数: 21
形式電荷: 0
複雑度: 253

実験および物理化学的性質

Cosmetics · 2 件

Cosmetic ingredients (Cetyl Phosphate) -> CIR (Cosmetic Ingredient Review)

Emulsifying

Physical DescriptionDry Powder; Liquid

物理化学的性質

融点: 71 °C · 71 °C
沸点: 439.8 · 439.8±28.0 °C(Predicted)
比重(密度): 1.013 · 1.013±0.06 g/cm3(Predicted)
蒸気圧: 0.146 Pa · 0.146Pa at 25℃
酸解離定数(Pka): 1.95 · 1.95±0.10(Predicted)
臭い (Odor): 100 · 100.00?%で。当たり障りのない
水溶解度: 1 mg/L · 1mg/L at 25℃
化粧品成分の機能: 界面活性剤 - 洗浄界面活性剤 - 乳化剤
InChI: InChI=1S/C16H35O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-21(17,18)19/h2-16H2,1H3,(H2,17,18,19)
InChIKey: ZUVCYFMOHFTGDM-UHFFFAOYSA-N
SMILES: C(OP(O)(O)=O)CCCCCCCCCCCCCCC
LogP: 6.65 at · 6.65 at 25℃
EPAの化学物質情報: 1 · 1-Hexadecanol, dihydrogen phosphate (3539-43-3)

安全と法規制

GHS分類

GHS Classification · 5 件

This chemical does not meet GHS hazard criteria for 14.6% (6 of 41) of reports.

Danger

H315 (70.7%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P354+P338, P317, P321, P332+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 5 件

Chemical: 1-Hexadecanol, dihydrogen phosphate

1-Hexadecanol, 1-(dihydrogen phosphate) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Hexadecanol, 1-(dihydrogen phosphate) 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)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 29-05-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/29649

1-Hexadecanol, dihydrogen phosphate: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Irrit. 2 (70.7%)

毒性情報

Toxicity Summary · 2 件

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...Cetyl Phosphate...

Safe for use in cosmetics, with qualifications