Triethyl Citrate

• CAS: 77-93-0
• Catalog Number: ACM77930-2
• Category: Polymer/Macromolecule
• Molecular Weight: 276.28
• Molecular Formula: C12H20O7
• 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
• 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
• Active Content: 95%
• 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 CAS number for Triethyl Citrate?

The CAS number for Triethyl Citrate is 77-93-0.

How is Triethyl Citrate described in terms of physical state?

Triethyl Citrate is described as a liquid and as a solid.

What is the molecular formula of Triethyl Citrate?

The molecular formula of Triethyl Citrate is C12H20O7.

What is the boiling point of Triethyl Citrate?

The boiling point of Triethyl Citrate is 126-127 °C at 1 mmHg.

What is the melting point of Triethyl Citrate?

The melting point of Triethyl Citrate is -55 °C.

What is the purity of Triethyl Citrate?

The purity of Triethyl Citrate is 99%.

What is the density of Triethyl Citrate?

The density of Triethyl Citrate is 1.14g/ml.

What are some typical applications of Triethyl Citrate?

Some typical applications of Triethyl Citrate include use as a plasticizer, dispersing agent, emulsion stabilizer, and lubricant.

What is the appearance of Triethyl Citrate?

Triethyl Citrate appears as a colorless to light yellow clear liquid.

What are some synonyms for Triethyl Citrate?

Some synonyms for Triethyl Citrate include Citric Acid Triethyl Ester and Triethyl 2-hydroxypropane-1,2,3-tricarboxylate.