CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Insoluble in water (0.022 mg/L at 25 deg C); [ChemIDplus] |
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Color/Form | Colorless liquid |
Solubility | Phthalate esters are soluble to various extents in many common organic solvents and oils, but have a relatively low solubility in water. /Phthalate esters/ |
Vapor Pressure | 0.0000236 [mmHg] |
Other Experimental Properties | Phthalate esters would be expected to have UV maxima in the 230 nm and 270 nm regions. /Phthalate esters/ |
Chemical Classes | Plastics & Rubber -> Phthalate Esters |
COMPUTED DESCRIPTORS
Molecular Weight | 334.4 g/mol |
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XLogP3 | 5.6 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 13 |
Exact Mass | 334.21440943 g/mol |
Monoisotopic Mass | 334.21440943 g/mol |
Topological Polar Surface Area | 52.6 Ų |
Heavy Atom Count | 24 |
Formal Charge | 0 |
Complexity | 367 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Butyl 2-ethylhexyl phthalate is a benzoate ester.