Benzyl ether - Materials / Alfa Chemistry

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Benzyl ether

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Catalog Number

ACMA00016847

Product Name

Benzyl ether

Category

Polymers

Description

Dibenzyl ether is a colorless liquid with a mild odor.;Liquid;Liquid;Colourless liquid, slightly mushroom aroma

IUPAC Name

phenylmethoxymethylbenzene

Molecular Weight

198.26g/mol

Molecular Formula

C14H14O

Canonical SMILES

C1=CC=C(C=C1)COCC2=CC=CC=C2

InChI

InChI=1S/C14H14O/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1-10H,11-12H2

InChI Key

MHDVGSVTJDSBDK-UHFFFAOYSA-N

Boiling Point

568 °F at 760 mm Hg (decomposes) (NTP, 1992);298.0 °C;295-298 °C WITH DECOMP

Melting Point

38.3 °F (NTP, 1992);3.6 °C;Mp 3-4 °;3.6 °C;3-4°C

Flash Point

275 °F (NTP, 1992);275 DEG (135 °C) (CLOSED CUP)

Density

1.0428 at 68 °F (USCG, 1999);d20 1.04;0.99735 AT 25 °C/4 °C;1.040-1.045

Solubility

less than 1 mg/mL at 70° F (NTP, 1992);0.04 mg/mL at 35 °C;PRACTICALLY INSOL IN WATER; MISCIBLE WITH ETHANOL, ETHER, CHLOROFORM, ACETONE;Water solubility = 40 mg/L at 35 °C;0.04 mg/mL at 35 °C;Insoluble in water, miscible in oils;soluble (in ethanol)

Color/Form

COLORLESS LIQUID;VERY PALE YELLOW

Complexity

137

Covalently-Bonded Unit Count

EC Number

203-118-2

Exact Mass

198.104465g/mol

Formal Charge

Heavy Atom Count

Log P

3.31 (LogP);3.31;Log Kow = 3.31;3.31

MeSH Entry Terms

dibenzyl ether

Monoisotopic Mass

198.104465g/mol

NSC Number

5931

Odor

FAINT, ALMOND ODOR;VERY SLIGHT ODOR OF BENZALDEHYDE

Other Experimental

SOLIDIFIES AT -0.5 TO +0.5 °C; DISSOLVES POLYSTYRENE WHEN HEATED; PEROXIDIZES IN AIR TO FORM BENZYL ALCOHOL & BENZALDEHYDE;Liquid molar volume = 0.190344 cu m/kmol;Heat of Fusion at melting point = 2.0209X10+7 J/kmol

Refractive Index

n20D 1.5610;INDEX OF REFRACTION: 1.54057 AT 20 °C, 1.566 AT 20 °C/D; 1.5601 @ 25 °C/D; 1.5381 @ 25 °C/D;1.558-1.563

Rotatable Bond Count

Stability

UNSTABLE; DECOMP SLOWLY AT ORDINARY TEMP;VOLATILE

UNII

2O6CNO27RJ

Vapor Density

6.84 (NTP, 1992) (Relative to Air)

Vapor Pressure

1 mm Hg at 77 °F ; 4 mm Hg at 122° F; 31 mm Hg at 203° F (NTP, 1992);0.00 mmHg;1.03X10-3 mm Hg @ 25 °C

Viscosity