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105-08-8

105-08-8 structural image
Product Name: 1,4-Cyclohexanedimethanol
Formula: C8H16O2
Synonyms: 1,4-Bis(hydroxymethyl)cyclohexane, mixture of cis and trans
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid, Other Solid; Other Solid
Color/Form Liquid
Odor Sweet (1,3/1,4-cyclohexanedimethanol mixture)
Boiling Point 286 °C (cis-isomer), 283 °C (trans-isomer)
Melting Point 43 °C (cis-isomer), 67 °C (trans-isomer)
Flash Point 166 °C
Solubility In water, 920,000 mg/L at 20 °C
Density 1.0381 at 25 °C/4 °C
Vapor Density 5 (Air = 1)
Vapor Pressure 3.08X10-4 mm Hg at 25 °C
LogP log Kow = 1.14 /Estimated by Experimental Value Adjustment method using cyclohexanediol/
Autoignition Temperature 600 °F (316 °C).
Decomposition When heated to decomposition it emits acrid smoke and fumes.
Viscosity 877 cP at 50 °C, supercooled
Refractive Index Index of refraction: 1.4893 at 20 °C/D
Chemical Classes Other Classes -> Alcohols and Polyols, Other

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05
GHS Hazard Statements H318:Serious eye damage/eye irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 144.21 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 144.115029749 g/mol
Monoisotopic Mass 144.115029749 g/mol
Topological Polar Surface Area 40.5 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 73.3
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

PRODUCT INTRODUCTION

description

See also: Polyester-5 (tg-38) (monomer of); Polyester-5 (TG-55) (monomer of); Polyester-5 (TG-48) (monomer of).