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Bis(2-ethylhexyl) sebacate Structure

Bis(2-ethylhexyl) sebacate

  • Product NameBis(2-ethylhexyl) sebacate
  • CAS122-62-3
  • CBNumberCB4852953
  • MFC26H50O4
  • MW426.67
  • EINECS204-558-8
  • MDL NumberMFCD00009497
  • MOL File122-62-3.mol

Chemical Properties

Melting point: −48 °C (−54 °F; 225 K)
Boiling point: 256 °C (493 °F; 529 K) at 0.7 kPa
Density  0.9 of water[vague]
vapor pressure  <0.01 hPa (20 °C)
refractive index  1.45
Flash point: 210 °C (410 °F; 483 K) open cup
storage temp.  Store below +30°C.
solubility  <1g/l
form  clear liquid
color  Colorless to Almost colorless
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)
Stability: Stable. Combustible. Incompatible with strong oxidizing agents.
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 Bis(2-ethylhexyl) sebacate (122-62-3)

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
PPE Eyeshields, Gloves
Safety Statements  24/25
WGK Germany  -
RTECS  VS1000000
TSCA  TSCA listed
HS Code  2917131000
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.
REACH Registrations Active
NFPA 704:
1
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