Basic information
- Standard SMILES
OCC(O)COCC(O)CO- InChIKey
GPLRAVKSCUXZTP-UHFFFAOYSA-N- Molecular formula
- C6H14O5
- Average molar mass
- 166.17 g/mol
- Monoisotopic mass
- 166.08412355
Overview
Diglycerol is an alkylglycerol.
Names & identifiers
- Preferred name
- Diglycerin
- IUPAC
- 3-(2,3-dihydroxypropoxy)propane-1,2-diol
- English name
- DIGLYCEROL
- Molecular formula
- C6H14O5
- Molecular weight
- 166.17
Names & synonyms
Show more names
Database identifiers
- CAS
59113-36-9、627-82-7- PubChem CID
- 42953
- DTXSID
DTXSID90872273- ChEBI
CHEBI:140430- UNII
- UC0A740LR3
- EC Number
- 211-013-8
- Nikkaji
- J6.871C
Properties
Computed structural properties
- XLogP
- -2.5
- Topological polar surface area
- 90.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 77
Experimental & physicochemical properties
Cosmetics
Cosmetic ingredients (Diglycerin) -> CIR (Cosmetic Ingredient Review)
Solvent; Humectant
Physicochemical properties
- Melting point
- 96 · 96-97 °C
- Boiling point
- 173 °C · 173 °C(Press: 14 Torr)
- Density
- 1.2774 g/cm3 · 1.2774 g/cm3
- vapor pressure
- 0 Pa · 0Pa at 20℃
- Viscosity
- 17474 mm2/s · 17474mm2/s
- Water Solubility
- 1000 g/L · 1000g/L at 20℃
- Cosmetics Ingredients Functions
- HUMECTANTSKIN CONDITIONING
- LogP
- -2.5 at · -2.5 at 20℃
- CAS DataBase Reference
- 59113 · 59113-36-9
- FDA UNII
- 3 YC120743U · 3YC120743U
- EPA Substance Registry System
- Propanediol, oxybis- (59113-36-9)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- TSCA
- TSCA listed
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 25.3% (23 of 91) of reports.
Warning
H315 (74.7%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 91 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Propanediol, oxybis- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanediol, oxybis- 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.
1,2-Propanediol, 3,3'-oxybis-: Does not have an individual approval but may be used under an appropriate group standard
Toxicology
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- REACH Registrations
- Active
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
Use Classification
EPA Safer Chemical Functional Use Classes -> Processing Aids and Additives
Safer Chemical Classes -> Green half-circle - The chemical is expected to be of low concern
Cosmetics -> Solvent; Humectant
General Manufacturing Information
Food, beverage, and tobacco product manufacturing
Propanediol, oxybis-: ACTIVE
Applications
DescriptionDiglycerol is soluble in water and is a colorless to light yellow liquid, which can be used as an intermediate in organic synthesis. It is mainly used for the preparation of fatty acid esters, used as emulsifiers and defoamers, etc.
UsesDiglycerol has excellent moisturizing properties and is a good water-based solvent. It can also be used as a moisturizing and moisturizing agent, softener, antifreeze agent, and can also be used in biodegradable plastics.
Upstream & downstream products
Downstream products
Suppliers50 total
Additional notes
DefinitionChEBI: Diglycerol is an alkylglycerol.
Related reactions
Linked notes
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