uspto-grants-1981_04 · 10.6084/m9.figshare.5104873.v1 · US04261982
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IDENTITY
结构与身份
- 标准SMILES
- CC(C)OC(=O)CCCCCCCCC(=O)OC(C)C
- InChIKey
- XFKBBSZEQRFVSL-UHFFFAOYSA-N
- 分子式
- C16H30O4
- 平均分子量
- 286.41 g/mol
- 单同位素质量
- 286.21440943
COMPUTED
结构计算性质
- XLogP
- 4.4
- 极性表面积
- 52.6 Ų
- 氢键供体
- 0
- 氢键受体
- 4
- 可旋转键
- 13
- 重原子
- 20
- 形式电荷
- 0
- 复杂度
- 244
GHS
GHS分类
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (97 of 97) of all reports.
Not Classified；Reported as not meeting GHS hazard criteria by 97 of 97 companies. For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 97 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 97 of 97 reports by companies.；There are 0 notifications provided by 0 of 97 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
HAZARDS
危害信息
Regulatory Information
Chemical: Decanedioic acid, bis(1-methylethyl) ester
Status: Active Update: 06-12-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/10094
Decanedioic acid, bis(1-methylethyl) ester: Does not have an individual approval but may be used under an appropriate group standard
EPA Safer Chemical
Chemical: Diisopropyl sebacate； Green circle - The chemical has been verified to be of low concern based on experimental and modeled data.
Hazard Classes and Categories
Not Classified
TOXICITY
毒理信息
Toxicity Summary
Safe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org
REGULATORY
法规信息
Regulatory Information
Chemical: Decanedioic acid, bis(1-methylethyl) ester
Status: Active Update: 06-12-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/10094
Decanedioic acid, bis(1-methylethyl) ester: Does not have an individual approval but may be used under an appropriate group standard
USES
用途与制造
Uses
CIR ingredient: Diisopropyl Sebacate
Household Products
Information on 17 consumer products that contain Diisopropyl sebacate in the following categories is provided:；• Personal Care
Use Classification
EPA Safer Chemical Functional Use Classes -> Solvents
Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern
Cosmetics -> Emollient
General Manufacturing Information
Decanedioic acid, 1,10-bis(1-methylethyl) ester: ACTIVE
ALIASES
名称与别名
DIISOPROPYL SEBACATE7491-02-3Decanedioic acid, bis(1-methylethyl) esterBis(1-methylethyl)decanedioateJ8T3X564IHDERMOL DIPSDTXSID3064720RefChem:134073bis(1-methylethyl) decanedioateDTXCID3047716decanedioic acid bis(1-methylethyl) ester231-306-4diisopropyl decanedioatedipropan-2-yl decanedioateMFCD00072272Decanedioic acid, 1,10-bis(1-methylethyl) esterdecanedioic acid diisopropyl esterdi-isopropyl sebacateIPSEPELEMOL DIPS
REACTIONS
参与反应