ChemicalBook--->CAS DataBase List--->122-62-3

122-62-3

122-62-3 Structure

122-62-3 Structure
IdentificationMore
[Name]

Dioctyl sebacate
[CAS]

122-62-3
[Synonyms]

BIS(2-ETHYLHEXYL)DECANEDIOATE
BIS(2-ETHYLHEXYL) SEBACATE
DI(2-ETHYLHEXYL) SEBACATE
DIOCTYL SEBACATE
'DIOCTYL' SEBACATE
SEBACIC ACID BIS(2-ETHYLHEXYL) ESTER
SEBACIC ACID DI(2-ETHYLHEXYL) ESTER
SEBACIC ACID DIOCTYL ESTER
1-Hexanol, 2-ethyl-, sebacate
2-ethyl-1-hexanosebacate
2-Ethylhexyl sebacate
2-ethylhexylsebacate
Bis(2-ethylhexyl) ester decanedionic acid
Bis(2-ethylhexyl) ester sebacic acid
bis(2-Ethylhexyl)decandeionate
Bis-(2-ethylhexyl)ester kyseliny sebakove
bis-(2-ethylhexyl)esterkyselinysebakove
Bis(ethylhexyl) sebacate
bis(ethylhexyl)sebacate
Bisoflex
[EINECS(EC#)]

204-558-8
[Molecular Formula]

C26H50O4
[MDL Number]

MFCD00009497
[Molecular Weight]

426.67
[MOL File]

122-62-3.mol
Chemical PropertiesBack Directory
[Appearance]

viscous colourless liquid
[Melting point ]

-55 °C
[Boiling point ]

212 °C1 mm Hg(lit.)
[density ]

0.914 g/mL at 25 °C(lit.)
[vapor pressure ]

<0.01 hPa (20 °C)
[refractive index ]

n20/D 1.450(lit.)
[Fp ]

>230 °F
[storage temp. ]

2-8°C
[solubility ]

<1g/l
[form ]

Liquid
[color ]

Clear slightly yellow
[Stability:]

Stable. Combustible. Incompatible with strong oxidizing agents.
[Water Solubility ]

<0.1 g/L (20 ºC)
[Merck ]

14,1251
[BRN ]

1806504
[Henry's Law Constant]

1.2×10-1 mol/(m3Pa) at 25℃, HSDB (2015)
[Cosmetics Ingredients Functions]

SOLVENT
FRAGRANCE
PERFUMING
PLASTICISER
[Cosmetic Ingredient Review (CIR)]

Bis(2-ethylhexyl) sebacate (122-62-3)
[InChI]

1S/C26H50O4/c1-5-9-17-23(7-3)21-29-25(27)19-15-13-11-12-14-16-20-26(28)30-22-24(8-4)18-10-6-2/h23-24H,5-22H2,1-4H3
[InChIKey]

VJHINFRRDQUWOJ-UHFFFAOYSA-N
[SMILES]

CCCCC(CC)COC(=O)CCCCCCCCC(=O)OCC(CC)CCCC
[LogP]

9.722 (est)
[CAS DataBase Reference]

122-62-3(CAS DataBase Reference)
[NIST Chemistry Reference]

Decanedioic acid, bis(2-ethylhexyl) ester(122-62-3)
[EPA Substance Registry System]

122-62-3(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

-
[RTECS ]

VS1000000
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29171390
[Storage Class]

10 - Combustible liquids
[Hazardous Substances Data]

122-62-3(Hazardous Substances Data)
[Toxicity]

mouse,LD50,oral,9500mg/kg (9500mg/kg),"Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 62, 1982.
Raw materials And Preparation ProductsBack Directory
[Raw materials]

2-Ethylhexanol-->Sebacic acid
Hazard InformationBack Directory
[General Description]

Clear pale yellow liquid with a mild odor. Insoluble in water.
[Reactivity Profile]

BIS(2-ETHYLHEXYL) SEBACATE(122-62-3) is an ester. Esters react with acids to liberate heat along with alcohols and acids. Strong oxidizing acids may cause a vigorous reaction that is sufficiently exothermic to ignite the reaction products. Heat is also generated by the interaction of esters with caustic solutions. Flammable hydrogen is generated by mixing esters with alkali metals and hydrides. This compound can react with oxidizing materials. BIS(2-ETHYLHEXYL) SEBACATE(122-62-3) will hydrolyze under acidic or basic conditions.
[Air & Water Reactions]

Insoluble in water.
[Fire Hazard]

This chemical is probably combustible.
[Chemical Properties]

viscous colourless liquid
[Uses]

In vacuum pumps.
[Production Methods]

Di(2-ethylhexyl) sebacate is manufactured by esterifying 2-ethylhexanol with sebacic acid in the presence of an acid catalyst.
[Flammability and Explosibility]

Notclassified(100%)
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Bis(2-ethylhexyl)sebacate(122-62-3).msds
Spectrum DetailBack Directory
[Spectrum Detail]

Dioctyl sebacate(122-62-3)1HNMR
Dioctyl sebacate(122-62-3)13CNMR
Dioctyl sebacate(122-62-3)IR1
Dioctyl sebacate(122-62-3)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Bis(2-ethylhexyl)sebacate, 97%(122-62-3)
[Alfa Aesar]

Bis(2-ethylhexyl) sebacate, 95%(122-62-3)
[Sigma Aldrich]

122-62-3(sigmaaldrich)
[TCI AMERICA]

Bis(2-ethylhexyl) Sebacate,>96.0%(GC)(122-62-3)
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