Quality Level

200

grade

ACS reagent
puriss. p.a.

vapor density

3.7 (vs air)

vapor pressure

13.3 mmHg ( 100 °C)
3.75 mmHg ( 77 °C)

assay

≥99.0% (GC)

form

liquid

autoignition temp.

817 °F

expl. lim.

0.34-6.3 %

impurities

≤0.01% benzaldehyde (C₆H₅CHO)
≤0.02% acetophenone
≤0.02% halogenated compounds (as Cl)
≤0.03% free acid (as benzoic acid)

evapn. residue

≤0.005%

ign. residue

≤0.005% (as SO₄)

refractive index

n20/D 1.539 (lit.)
n20/D 1.541

bp

203-205 °C (lit.)

mp

−16-−13 °C (lit.)

solubility

H₂O: 33 mg/mL at 20 °C, clear, colorless

density

1.045 g/mL at 25 °C (lit.)

cation traces

Al: ≤0.5 mg/kg
Ba: ≤0.1 mg/kg
Bi: ≤0.1 mg/kg
Ca: ≤0.5 mg/kg
Cd: ≤0.05 mg/kg
Co: ≤0.02 mg/kg
Cr: ≤0.02 mg/kg
Cu: ≤0.02 mg/kg
Fe: ≤0.5 mg/kg
K: ≤0.5 mg/kg
Li: ≤0.1 mg/kg
Mg: ≤0.1 mg/kg
Mn: ≤0.02 mg/kg
Mo: ≤0.1 mg/kg
Na: ≤2 mg/kg
Ni: ≤0.02 mg/kg
Pb: ≤0.1 mg/kg
Sr: ≤0.1 mg/kg
Zn: ≤0.1 mg/kg

SMILES string

OCc1ccccc1

InChI

1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2

Inchi Key

WVDDGKGOMKODPV-UHFFFAOYSA-N