CAS 112-36-7 Diethylene glycol diethyl ether

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Diethylene glycol diethyl ether

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Catalog Number

ACM112367-1

CAS Number

112-36-7

Product Name

Diethylene glycol diethyl ether

Structure

Category

Plastic Additives; Plasticizers

Synonyms

Bis(2-ethoxyethyl) ether;Ether, bis(2-ethoxyethyl);Diethoxydiglycol

Description

Diethylene glycol diethyl ether is a clear colorless viscous liquid. (NTP, 1992);Liquid;COLOURLESS VISCOUS LIQUID.

IUPAC Name

1-Ethoxy-2-(2-ethoxyethoxy)ethane

Molecular Weight

162.23

Molecular Formula

C8H18O3

Canonical SMILES

CCOCCOCCOCC

InChI

RRQYJINTUHWNHW-UHFFFAOYSA-N

InChI Key

InChI=1S/C8H18O3/c1-3-9-5-7-11-8-6-10-4-2/h3-8H2,1-2H3

Boiling Point

180-190 °C(lit.)

Melting Point

-44.3 °C

Flash Point

160 °F

Purity

98%+

Density

0.909g/ml

Solubility

greater than or equal to 100 mg/mL at 66° F (NTP, 1992);6.16 M;Very soluble in ethanol, organic solvents; soluble in ethyl ether;Soluble in hydrocarbons;Infinite /1.0X10+6 mg/L/ solubility water at 25 °C;Solubility in water: very good

Appearance

Colorless clear liquid

Color/Form

Colorless liquid

Complexity

58.4

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

EC Number

203-963-7

Exact Mass

162.125594432

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

ICSC Number

1151

Isotope Atom Count

Log P

0.39 (LogP);log Kow = 0.39;0.39

Monoisotopic Mass

162.125594432

Other Experimental

EQUIVALENCIES: 1 PPM EQUALS 6.64 MG/CU M @ 25 °C, 760 MM HG; 1 MG/L EQUALS 150.8 PPM @ 25 DEG, 760 MM HG. PER CENT IN SATURATED AIR: 0.066 @ 25 °C. VAPOR PRESSURE = 0.5 MM HG @ 25 °C (APPROX);Liquid molar volume = 0.179481 cu m/kmol;wt/gal: 7.56 at 20 °C ... combustible;Henry's Law constant = 1.11X10-7 atm-cu m/mol at 25 °C (est);Hydroxyl radical reaction rate constant = 2.68X10-11 cu cm/molec-sec at 25 °C

Refractive Index

Index of refraction: 1.4115 at 20 °C/D

Rotatable Bond Count

RTECS Number

KN3160000

Stability

Extremely stable

Topological Polar Surface Area

27.7 Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

UNII