CAS 77-89-4 Acetyl triethyl citrate - Materials / Alfa Chemistry

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Acetyl triethyl citrate

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Catalog Number

ACM77894-4

CAS Number

77-89-4

Product Name

Acetyl triethyl citrate

Structure

Category

Plastic Additives

Synonyms

Triethyl O-acetylcitrate

IUPAC Name

Triethyl 2-acetyloxypropane-1,2,3-tricarboxylate

Molecular Weight

318.32

Molecular Formula

C14H22O8

Canonical SMILES

CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)OC(=O)C

InChI

InChI=1S/C14H22O8/c1-5-19-11(16)8-14(22-10(4)15,13(18)21-7-3)9-12(17)20-6-2/h5-9H2,1-4H3

InChI Key

WEAPVABOECTMGR-UHFFFAOYSA-N

Boiling Point

228-229 °C

Melting Point

-42°C

Flash Point

>230 °F

Purity

>97.0%(GC)

Density

1.136 g/mL

Appearance

colorless or light yellow liquid

Complexity

395

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

EC Number

201-066-5

Exact Mass

318.13146766

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

Monoisotopic Mass

318.13146766

Rotatable Bond Count

Safety Description

23-24/25

Topological Polar Surface Area

105 Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

Viscosity

53.7cp (25°C)

WGK Germany

MSDS

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COA

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Spec Sheet

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77-89-4
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