Triethyl Citrate

• Catalog Number: ACM77930-2
• Product Name: Triethyl Citrate
• CAS: 77-93-0
• Category: Polymer/Macromolecule
• Description: Liquid;Odourless, practically colourless, oily liquid;Solid;COLOURLESS OILY LIQUID.;practically colourless, oily liquid; bitter taste; little odour
• Synonyms: 2,3-Propanetricarboxylicacid,2-hydroxy-triethylester
• IUPAC Name: Triethyl 2-hydroxypropane-1,2,3-tricarboxylate
• Molecular Weight: 276.28
• Molecular Formula: C12H20O7
• Canonical SMILES: CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)O
• InChI: 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
• InChI Key: DOOTYTYQINUNNV-UHFFFAOYSA-N
• Boiling Point: 235 °C/150 mmHg(lit.)
• Melting Point: -55 °C
• Flash Point: >230 °F
• Density: 1.14 g/mL at 25 °C(lit.)
• Solubility: Slightly soluble in water
• Appearance: Clear liquid
• Storage: Store below +30 °C
• Alpha Sort: Triethyl citrate
• Color/Form: Oily liquid;Colorless, mobile liquid
• Complexity: 304
• Covalently-Bonded Unit Count: 1
• Decomposition: When heated to decomposition it emits acrid smoke and irritatiing fumes.
• Defined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• EC Number: 201-070-7;201-070-7
• Exact Mass: 276.12090297
• Formal Charge: 0
• H-Bond Acceptor: 7
• H-Bond Donor: 1
• Heavy Atom Count: 19
• Hydrogen Bond Acceptor Count: 7
• Hydrogen Bond Donor Count: 1
• ICSC Number: 1350
• Isotope Atom Count: 0
• Monoisotopic Mass: 276.12090297
• NSC Number: 8907
• Odor: Fruity odor
• Other Experimental: Pour point about 10 °C;Vapor pressure = 1 mm Hg at 107.0 °C;Pour point -46 °C;Henry's Law constant = 3.8X10-9 atm-cu m/mole at 25 °C (est);Hydroxyl radical reaction rate constant = 7.3X10-12 cu cm/mole-sec at 25 °C (est)
• Physical State: Liquid
• pKa: 11.57±0.29(Predicted)
• Refractive Index: n20/D 1.442(lit.)
• Rotatable Bond Count: 11
• RTECS Number: GE8050000
• Stability: Stable under recommended storage conditions.
• Topological Polar Surface Area: 99.1 Ų
• Undefined Atom Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• UNII: 8Z96QXD6UM
• Vapor Pressure: 6.87e-04 mmHg;6.87X10-4 mm Hg at 25 °C (extrapolated);Vapor pressure, Pa at 25 °C: 0.3
• Viscosity: 35.2 cP at 25 °C
• XLogP3: 0.1

Custom Q&A

What is the molecular formula of Triethyl citrate?

The molecular formula of Triethyl citrate is C12H20O7.

What is the molecular weight of Triethyl citrate?

The molecular weight of Triethyl citrate is 276.28 g/mol.

What is Triethyl citrate used for?

Triethyl citrate is used in foods as a flavoring agent, solvent, and surface-active agent. It is also used in pharmaceutical coatings and plastics.

What is the IUPAC name of Triethyl citrate?

The IUPAC name of Triethyl citrate is triethyl 2-hydroxypropane-1,2,3-tricarboxylate.

What is the CAS number of Triethyl citrate?

The CAS number of Triethyl citrate is 77-93-0.

What is the EC number of Triethyl citrate?

The EC number of Triethyl citrate is 201-070-7.

What is the FEMA number of Triethyl citrate?

The FEMA number of Triethyl citrate is 3083.

What is the JECFA number of Triethyl citrate?

The JECFA number of Triethyl citrate is 629.

What is the UNII of Triethyl citrate?

The UNII of Triethyl citrate is 8Z96QXD6UM.

What is the Wikipedia page for Triethyl citrate?

The Wikipedia page for Triethyl citrate is Triethyl_citrate.