2-Phenylphenol - Materials / Alfa Chemistry

NAVIGATION

2-Phenylphenol

PRICE INQUIRY

Catalog Number

ACMA00017290

Product Name

2-Phenylphenol

Category

Polymers

Description

2-phenylphenol appears as light lavender crystals or solid. (NTP, 1992);Solid;WHITE CRYSTALS.;White to light purple crystals

IUPAC Name

2-phenylphenol

Molecular Weight

170.21g/mol

Molecular Formula

C12H10O;C6H5C6H4OH;C12H10O

Canonical SMILES

C1=CC=C(C=C1)C2=CC=CC=C2O

InChI

InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H

InChI Key

LLEMOWNGBBNAJR-UHFFFAOYSA-N

Boiling Point

527 °F at 760 mm Hg (NTP, 1992);286.0 °C;286 °C;286 °C

Melting Point

131.9 to 135.5 °F (NTP, 1992);59.0 °C;59 °C;56°C;58-60 °C

Flash Point

255 °F (NTP, 1992);Value: 138 degree C Type: closed cup;124 °C c.c.

Density

1.213 at 77 °F (NTP, 1992);1.213 g/cu cm at 25 °C;Relative density (water = 1): 1.2

Solubility

less than 0.1 mg/mL at 68.9° F (NTP, 1992);0.00 M;Soluble in fixed alkali hydroxide solutions and most organic solvents.;Soluble in sodium hydroxide;Soluble in ethanol, acetone, benzene, chloroform, and ligroin; very soluble in ethyl ether and pyridine.;Sol in most organic solvents, including ethanol, ethylene glycol, isopropanol, glycolethers, and polyglycols.;At 20 °C, g/kg solvent: in methanol, 500; in acetone, 479; in acetonitrile, 532; in octanol, 529; in toluene, 466; in hexane 48.6;In water, 700 mg/L at 25 °C;0.7 mg/mL at 25 °C;Solubility in water, g/l at 20 °C: 0.2 (very poor);insoluble in water;moderately soluble (in ethanol)

Color/Form

Needles from petroleum ether;Colorless to pinkish crystals;White, flaky crystals

Complexity

149

Covalently-Bonded Unit Count

EC Number

201-993-5;262-974-5

Exact Mass

170.073165g/mol

Formal Charge

Heavy Atom Count

ICSC Number

0669

Log P

3.09 (LogP);log Kow = 3.09;3.09;3.2

MeSH Entry Terms

2-hydroxybiphenyl;2-hydroxydiphenyl;2-phenylphenol;2-phenylphenol sodium;Dowicide;Lyorthol;o-phenylphenate;o-phenylphenol;ortho-phenylphenate;orthophenylphenol;sodium o-phenylphenoate;sodium ortho-phenylphenate;sodium ortho-phenylphenol

Monoisotopic Mass

170.073165g/mol

NSC Number

1548

Odor

Mild characteristic odor;Sweetish odor;Phenolic odor

Other Experimental

FORMS SALTS OF WHICH THOSE OF THE ALKALI METALS ARE WATER-SOLUBLE; THE SODIUM SALT CRYSTALLIZES AS A TETRAHYDRATE, SOLUBILITY CIRCA 1.1 KG/KG WATER (35 °C), GIVING A SOLUTION OF PH 12.0-13.5.;VAPOR PRESSURE: 1 MM HG @ 100.0 °C;Vapor Pressure: 20 mm Hg at 163 °C; 100 mm Hg at 206 °C;o-Phenylphenol can be oxidized by air to form the corresponding phenylbenzoquinone [363- 03-1];Henry's Law constant = 1.05X10-6 atm-cu m/mol at 25 °C (est);Hydroxyl radical reaction rate constant = 2.7X10-11 cu cm/molec-sec at 25 °C (est)

Rotatable Bond Count

RTECS Number

DV5775000

Stability

Stable at normal conditions.

UNII

D343Z75HT8

UN Number

3077;3077

Vapor Pressure

1 mm Hg at 212 °F (NTP, 1992);0.00 mmHg;2.0X10-3 mm Hg at 25 °C;Vapor pressure, Pa at 20 °C: 0.07

XLogP3