Basic information
- CAS
70693-32-2- Standard SMILES
CC(C)(CO)CO.CCCCCCCC(=O)O.CCCCCCCCCC(=O)O- InChIKey
PDYOTPOJFZAOIS-UHFFFAOYSA-N- Molecular formula
- C10H20O2.C8H16O2.C5H12O2
- Average molar mass
- 420.6 g/mol
Names & identifiers
- Preferred name
- Decanoic acid, mixed esters with neopentyl glycol and octanoic acid
- IUPAC
- decanoic acid;2,2-dimethylpropane-1,3-diol;octanoic acid
- English name
- Neopentyl glycol dicaprylate/dicaprate
- Molecular formula
- C41H80O8
- Molecular weight
- 420.62
Names & synonyms
UNII-VLW429K27KEINECS 274-764-0EC 274-764-0RefChem:131216DTXSID40894586SCHEMBL2531351VLW429K27Kdecanoic acid;2,2-dimethylpropane-1,3-diol;octanoic acidNeopentyl glycol dicaprylate/dicaprateNeopentylGlycolOctanoateDecanoateNeopentylglycol didecanoate-dioctanoateDecanoic acid, mixed esters with neopentyl glycol and octanoic acid
Database identifiers
- CAS
70693-32-2- PubChem CID
- 116802
- EC Number
- 274-764-0
Properties
Computed structural properties
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 16
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 244
Experimental & physicochemical properties
UVCBUVCB -> EPA TSCA
CosmeticsCosmetic ingredients (Neopentyl Glycol Dicaprylate/Dicaprate) -> CIR (Cosmetic Ingredient Review)
Physical DescriptionLiquid
Physicochemical properties
- Water Solubility
- 92.9 μg/L · 92.9μg/L at 20℃
- Cosmetics Ingredients Functions
- SKIN CONDITIONINGSKIN CONDITIONING - EMOLLIENT
- Cosmetic Ingredient Review (CIR)
- Neopentyl glycol dicaprylate/dicaprate (70693-32-2)
- LogP
- 3.965 · 3.965 (est)
- FDA UNII
- 429 K27K · VLW429K27K
- EPA Substance Registry System
- Decanoic acid mixed esters with neopentyl glycol and octanoic acid (70693-32-2)
- TSCA
- TSCA listed
- REACH Registrations
- Active
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (72 of 72) of all reports.
Not Classified
Aggregated GHS information provided per 72 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: Decanoic acid, mixed esters with neopentyl glycol and octanoic acid
Decanoic acid, mixed esters with neopentyl glycol and octanoic acid is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Decanoic acid, mixed esters with neopentyl glycol and octanoic acid 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)
Status: Active Update: 23-06-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/5326
Decanoic acid, mixed esters with neopentyl glycol and octanoic acid: 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.
Hazard Classes and CategoriesNot Classified
Toxicology
Toxicity SummarySafe 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
Safety data
- tsca
- TSCA listed
- REACH Registrations
- Active
Chemistry & industry
Uses & manufacturing
UsesCIR ingredient: Neopentyl Glycol Dicaprylate/Dicaprate
U.S. Production2023: <75,000 lb
Consumer UsesLubricating agent
Industry UsesLubricating agent
Household ProductsInformation on 1 consumer products that contain Neopentyl Glycol Dicaprylate/Dicaprate in the following categories is provided:
General Manufacturing Information
Petroleum Lubricating Oil and Grease Manufacturing
Decanoic acid, mixed esters with neopentyl glycol and octanoic acid: ACTIVE
Applications
Usesneopentyl glycol dicaprylate/dicaprate is an emollient and formula viscosity-increasing agent used mostly in the manufacturing of lipsticks.
Suppliers27 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
山东泰诚生物科技有限公司18769832557 18769832557 · [email protected]
深圳市星凯越生物科技有限公司0755-18589069862 18589069862 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
湖北兴琰新材料科技有限公司13129948835 · [email protected]
武汉贝乐叶生物医药科技有限公司18086118076; 18086118070 · [email protected]
湖北楚盛威化工有限公司87891008 18971625309 · [email protected]
武汉贝乐叶生物医药科技有限公司18086118078 · [email protected]
湖北世腾化工科技有限公司18971850150 19086915685 · [email protected]
武汉福鑫化工有限公司+86-2759207851; +86-18007136271 · [email protected]
河南沃咖斯生物科技有限公司18537671377 · [email protected]
湖北美钡新材料有限公司18271819653 · [email protected]
河北贞佳新材料有限公司0319-5925599 13315915972 · [email protected]
湖北世腾化工科技有限公司19086915685 18971850150 · [email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
武汉弘德悦欣医药科技有限公司02783850058 15377551550 · [email protected]
上海问彩新材料科技有限公司15721586846 · [email protected]
合肥博美生物科技有限责任公司13739298932 13856598764 · [email protected]
湖北斯维图新材料科技有限公司13277095679 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
武汉浩荣生物科技有限公司18186132299 18186132299 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
武汉卡米克科技有限公司18162538168 · [email protected]
南京择优新材料科技有限公司180-86404407 17340521416 · [email protected]
武汉青衫合源生物科技有限公司027-18327024450 18327024450 · [email protected]
武汉弘德悦欣医药科技有限公司027-83855391 13657260109 · [email protected]
湖北省汉卿生物医药科技有限公司15827479330 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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