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2459-10-1

2459-10-1 structural image
Product Name: TRIMETHYL 1,2,4-BENZENETRICARBOXYLATE
Formula: C12H12O6
Synonyms: Trimethyl trimellitate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description White solid; [MSDSonline]
Boiling Point 194 °C at 12 mm Hg
Melting Point -13 °C
Density 1.261
Refractive Index Index of Refraction= 1.5230 at 20 °C
Kovats Retention Index 1800 1783.7 1800.7 1800
Chemical Classes Plastics & Rubber -> Phthalate Esters

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H317:Sensitisation, Skin
H319:Serious eye damage/eye irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 252.22 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 252.06338810 g/mol
Monoisotopic Mass 252.06338810 g/mol
Topological Polar Surface Area 78.9 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 338
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes