Basic information
- CAS
15872-89-6- Standard SMILES
CCCCCCCOC(=O)CCC(=O)OCCCCCCC- InChIKey
PBZAGXRVDLNBCJ-UHFFFAOYSA-N- Molecular formula
- C18H34O4
- Average molar mass
- 314.5 g/mol
- Monoisotopic mass
- 314.24570957
Names & identifiers
- Preferred name
- Diheptyl succinate
- IUPAC
- diheptyl butanedioate
- English name
- diheptyl succinate
- Molecular formula
- C18H34O4
- Molecular weight
- 314.46
Names & synonyms
Diheptyl succinate15872-89-6Butanedioic acid, diheptyl esterUNII-057N7SS26YLEXFEEL DHS057N7SS26YEINECS 239-996-9DTXSID10166505SUCCINIC ACID, DIHEPTYL ESTERBUTANEDIOIC ACID, 1,4-DIHEPTYL ESTERRefChem:133658DTXCID7088996
Show more names
Succinic acid diheptyl esterButanedioic acid diheptyl ester
DIHEPTYL SUCCINATE [INCI]239-996-9PBZAGXRVDLNBCJ-UHFFFAOYSA-Ndiheptyl butanedioateSCHEMBL333031NS00025167Q27236090
Database identifiers
- CAS
15872-89-6- PubChem CID
- 85155
- DTXSID
DTXSID10166505- UNII
- 057N7SS26Y
- EC Number
- 239-996-9
- Nikkaji
- J120.633H
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 17
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 248
Physicochemical properties
- Boiling point
- 351.3 · 351.3±10.0 °C(Predicted)
- Density
- 0.945 · 0.945±0.06 g/cm3(Predicted)
- vapor pressure
- 14 hPa · 14hPa at 30℃
- Water Solubility
- 1 mg/L · 1mg/L at 20℃
- Cosmetics Ingredients Functions
- SKIN CONDITIONINGSKIN CONDITIONING - EMOLLIENT
- LogP
- 5.1 at · 5.1 at 20℃
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 57 N7SS26Y · 057N7SS26Y
- 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% (2 of 2) of all reports.
Not Classified
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: Butanedioic acid, 1,4-diheptyl ester
Status: Active Update: 15-02-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/27646
Hazard Classes and CategoriesNot Classified
Safety data
- REACH Registrations
- Active
Chemistry & industry
Uses & manufacturing
Household ProductsInformation on 2 consumer products that contain Diheptyl Succinate in the following categories is provided:
Upstream & downstream products
Upstream raw materials
Suppliers3 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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