Completing data — usually done within a minute
Basic information
- CAS
103-23-1- Standard SMILES
CCCCC(CC)COC(=O)CCCCC(=O)OCC(CC)CCCC- InChIKey
SAOKZLXYCUGLFA-UHFFFAOYSA-N- Molecular formula
- C22H42O4
- Average molar mass
- 370.574 g/mol
- Monoisotopic mass
- 370.30830982
Names & identifiers
- Preferred name
- Bis(2-ethylhexyl)hexanedioate
- IUPAC
- Bis(2-ethylhexyl) hexanedioate
- English name
- Bis(2-ethylhexyl) adipate
- Molecular formula
- C22H42O4
- Molecular weight
- 370.57
Names & synonyms
DEHAHexanedioic acid, bis(2-ethylhexyl) esterDiethylhexyl adipatedioctylBis(2-ethylhexyl)hexanedioatebis(2-ethylhexyl)Behahexanedioicacidbis(2-ethylhexyl)esterPX-238mollans
Database identifiers
- CAS
103-23-1、70147-21-6- PubChem CID
- 7641
- DTXSID
DTXSID0020606- ChEMBL
CHEMBL1414950- ChEBI
CHEBI:34675- UNII
- MBY1SL921L
- EC Number
- 203-090-1、615-074-5、686-861-9
- Nikkaji
- J3.602A
Properties
Physicochemical properties
- Melting point
- -67 °C · -67 °C
- Boiling point
- 417 °C · 417 °C
- Density
- 0.925 g/mL · 0.925 g/mL at 20 °C(lit.)
- Pour Point
- -65 · -65
- vapor pressure
- 0.001 hPa · <0.001 hPa (20 °C)
- refractive index
- 20 · n20/D 1.447(lit.)
- Flash point
- 230 °F · >230 °F
- storage temp.
- 30 °C · Store below +30°C.
- solubility
- 0.0001 g/l · <0.0001g/l
- form
- Liquid
- Specific Gravity
- 0.99 · 0.99
- color
- Clear colorless
- PH
- 7 · 7 (H2O, 20℃)
- explosive limit
- 0.24 % · 0.24%(V)
- biological source
- synthetic
- Viscosity
- 8.2 cs · 8.2cs (37.8C)
- Water Solubility
- immiscible
- BRN
- 1803774 · 1803774
- Henry's Law Constant
- 2.3 · 2.3×101 mol/(m3Pa) at 25℃, Felder et al. (1986)
- Stability
- Stable. Incompatible with oxidizing agents, water, nitrates.
- Cosmetics Ingredients Functions
- SKIN CONDITIONING - EMOLLIENTPLASTICISERSKIN CONDITIONINGSOLVENTFILM FORMING
- Cosmetic Ingredient Review (CIR)
- Bis(2-ethylhexyl) adipate (103-23-1)
- InChI
- 1S/C22H42O4/c1-5-9-13-19(7-3)17-25-21(23)15-11-12-16-22(24)26-18-20(8-4)14-10-6-2/h19-20H,5-18H2,1-4H3
Safety & regulation
Safety data
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- AU9700000
- ridadr
- UN 1230 3/PG 2
- hs_code
- 29171290
- Toxicity
- LD50 orally in Rabbit: > 5000 mg/kg LD50 dermal Rabbit 8410 mg/kg
- risk_code
- 36/38-40-39/23/24/25-23/24/25-11
- Signal word
- Danger
- Symbol(GHS)
- GHS06,GHS08
- hazard_code
- Xi,Xn,T,F
- safety_code
- 26-36-45-36/37-16-7-24/25
- hazard_class
- 9
- Storage Class
- 10 - Combustible liquids
- packing_group
- III
- Hazard statements
- H301-H311-H331-H370
- REACH Registrations
- Active
- Autoignition Temperature
- 350 °C DIN 51794
- Precautionary statements
- P260-P280-P301+P310-P311
- Hazardous Substances Data
- 103-23-1(Hazardous Substances Data)
Chemistry & industry
Applications
UsesThe compound is used as a plasticizer for flexible vinyl food wraps and as a solvent for aircraft lubricants.
UsesPlasticizer in polyvinyl chloride films, sheeting, extrusions, and plastisols; solvent and emollient in cosmetics
UsesBis(2-ethylhexyl) adipate also known as dioctyl adipate (DOA) can be used as a plasticizer for improving the impact properties of polymers. DOA is also used to produce clear films for food packaging applications and in synthetic rubber industries due to its compatibility with nitrocellulose and ethylcellulose.
General DescriptionColorless to straw-colored liquid with a mild odor. Floats on water.
Upstream & downstream products
Upstream raw materials
Downstream products
Additional notes
DefinitionChEBI: A diester resulting from the formal condensation of the carboxy groups of adipic acid with 2-ethylhexan-1-ol. It is used as a plasticiser in the preparation of various polymers.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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