Triethyl citrate Structure

Triethyl citrate

Chemical Properties

Melting point -55 °C
Boiling point 235 °C/150 mmHg (lit.)
Density  1.14 g/mL at 25 °C (lit.)
vapor density  9.7 (vs air)
Pour Point  -46
vapor pressure  1 mm Hg ( 107 °C)
refractive index  n20/D 1.442(lit.)
FEMA  3083 | TRIETHYL CITRATE
FLAVIS Number 09.512 | Triethyl citrate
Flash point >230 °F
storage temp.  Store below +30°C.
solubility  H2O: soluble
form  Liquid
pka 11.57±0.29(Predicted)
color  Clear
Odor odorless
biological source synthetic
Viscosity 35.2cp (25C)
Water Solubility  5.7 g/100 mL (25 ºC)
FreezingPoint  -55℃
Merck  14,2326
JECFA Number 629
BRN  1801199
Major Application flavors and fragrances
Cosmetics Ingredients Functions VISCOSITY CONTROLLING
DEODORANT
PERFUMING
PLASTICISER
SOLVENT
FRAGRANCE
InChI 1S/C12H20O7/c1-4-17-9(13)7-12(16,11(15)19-6-3)8-10(14)18-5-2/h16H,4-8H2,1-3H3
InChIKey DOOTYTYQINUNNV-UHFFFAOYSA-N
SMILES CCOC(=O)CC(O)(CC(=O)OCC)C(=O)OCC
LogP 1.267 (est)
SCOGS (Select Committee on GRAS Substances) Triethyl citrate
CAS DataBase Reference 77-93-0(CAS DataBase Reference)
Substances Added to Food (formerly EAFUS) TRIETHYL CITRATE
FDA 21 CFR 175.300; 175.320; 181.27
EWG's Food Scores 1
FDA UNII 8Z96QXD6UM
NIST Chemistry Reference Ethyl citrate(77-93-0)
EPA Substance Registry System Triethyl citrate (77-93-0)
UNSPSC Code 85151701
NACRES NA.41

Safety

Hazard Codes  Xn
Risk Statements  20
Safety Statements  24/25-45
WGK Germany  1
RTECS  GE8050000
TSCA  TSCA listed
HS Code  2918 15 00
Storage Class 10 - Combustible liquids
Hazardous Substances Data 77-93-0(Hazardous Substances Data)
Toxicity LD50 orally in Rabbit: > 3200 mg/kg LD50 dermal Rabbit > 5000 mg/kg
NFPA 704:
1
0

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