基本情報
- 標準SMILES
CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCC- InChIKey
GKAVWWCJCPVMNR-UHFFFAOYSA-N- 分子式
- C31H62O2
- 平均分子量
- 466.8 g/mol
- 単同位体質量
- 466.47498122
概要
The CIR Expert Panel concluded that the alkyl esters, listed subsequently, are safe in the present practices of use and concentration described in this safety assessment when formulated to be non-irritating.
名称と識別子
- 優先名称
- Tridecyl Stearate
- IUPAC
- tridecyl octadecanoate
- 英語名
- Octadecanoic acid, C11-14-isoalkyl esters, C13-rich
- 分子式
- C31H62O2
- 分子量
- 466.82278
名称と別名
名称をさらに表示
データベース識別子
- CAS
120525-96-4、31556-45-3- PubChem CID
- 35847
- DTXSID
DTXSID2027967- UNII
- A8OE252M6L
- EC Number
- 250-696-7
- Nikkaji
- J278.143C
物性
構造計算による物性
- XLogP
- 14.7
- 極性表面積
- 26.3 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 2
- 回転可能結合数
- 29
- 重原子数
- 33
- 形式電荷
- 0
- 複雑度
- 366
実験および物理化学的性質
Cosmetics
Cosmetic ingredients (Tridecyl Stearate) -> CIR (Cosmetic Ingredient Review)
Emollient; Skin conditioning
物理化学的性質
- EPAの化学物質情報
- -13 · C-13-Rich C11-14-isoalkyl stearates (120525-96-4)
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (40 of 40) of all reports.
Not Classified
Aggregated GHS information provided per 40 reports by companies from 1 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: Octadecanoic acid, tridecyl ester
Octadecanoic acid, tridecyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Octadecanoic acid, tridecyl ester 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)
Octadecanoic acid, tridecyl 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.
毒性情報
Toxicity Summary
The CIR Expert Panel concluded that the alkyl esters, listed subsequently, are safe in the present practices of use and concentration described in this safety assessment when formulated to be non-irritating.
Safe for use in cosmetics, with qualifications
安全データ
- tsca
- TSCA listed
化学と産業
用途と製造
General Manufacturing Information
Not Known or Reasonably Ascertainable
Octadecanoic acid, tridecyl ester: ACTIVE
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関連反応
現在のフィルター条件では反応記録がありません。
関連ノート
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