4'-Hydroxyacetophenone

Inquiry

For Research Use Only.

Category

Phenols

Cat.No.

NP5341

CAS

99-93-4

Product Name

4'-Hydroxyacetophenone

Structure

Product Details

Description

An Acetaminophen impurity.

Synonyms

1-(4-hydroxyphenyl)ethanone

IUPAC Name

1-(4-hydroxyphenyl)ethanone

Molecular Weight

136.15

Molecular Formula

C8H8O2

Canonical SMILES

CC(=O)C1=CC=C(C=C1)O

InChI

InChI=1S/C8H8O2/c1-6(9)7-2-4-8(10)5-3-7/h2-5,10H,1H3

InChIKey

TXFPEBPIARQUIG-UHFFFAOYSA-N

Boiling Point

313 ℃ / 760 mmHg

Melting Point

101-103 ℃

Flash Point

>235.4 °F

Purity

≥ 98 %, ≥ 95 % e.e.

Density

1.109 g/cm³

Solubility

In Vitro:
DMSO : 100 mg/mL(734.48 mM;Need ultrasonic)
In Vivo:
1.Add each solvent one by one:10% DMSO >> 40% PEG300 >> 5% Tween-80 >> 45% saline
Solubility: ≥ 2.5 mg/mL (18.36 mM); Clear solution
2.Add each solvent one by one:10% DMSO >> 90% (20% SBE-β-CD in saline)
Solubility: ≥ 2.5 mg/mL (18.36 mM); Clear solution
3.Add each solvent one by one:10% DMSO >> 90% corn oil
Solubility: ≥ 2.5 mg/mL (18.36 mM); Clear solution

Appearance

White crystal

Application

anti-inflammatory;

Storage

Inert atmosphere. Room temperature.

EINECS

202-802-8

Form

Powder

Hazard Codes

HS Code