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4-Nitrobenzeneethanol

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4-Nitrobenzeneethanol Basic information

Product Name:
4-Nitrobenzeneethanol
Synonyms:
  • p-Nitrophenylethyl alcohol
  • 4-Nitrophenethyl Alcohol 2-(4-Nitrophenyl)ethyl Alcohol
  • Benzeneethanol,4-nitro-
  • 4-Nitrobenzeneethanol, 99%, 99%
  • 4-Nitrophenethyl alcohol,2-(4-Nitrophenyl)ethanol
  • 2-(4-Nitrophenyl)ethan-1-ol, 4-(2-Hydroxyethyl)nitrobenzene
  • 2-(4-Nitrophenyl)ethanol, 99+%
  • SS-P-NITROPHENYLETHANOL
CAS:
100-27-6
MF:
C8H9NO3
MW:
167.16
EINECS:
202-835-8
Product Categories:
  • Aromatic alcohols and diols
Mol File:
100-27-6.mol
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4-Nitrobenzeneethanol Chemical Properties

Melting point:
59-62 °C(lit.)
Boiling point:
177 °C16 mm Hg(lit.)
Density 
1.2917 (rough estimate)
refractive index 
1.5570 (estimate)
storage temp. 
Sealed in dry,Room Temperature
solubility 
Chloroform, Methanol (Slightly)
form 
Solid
pka
14.57±0.10(Predicted)
color 
White to Light Brown
Water Solubility 
<0.01 g/100 mL at 18 ºC
BRN 
1866148
Stability:
Stable. Combustible. Incompatible with strong oxidizing agents, strong bases.
CAS DataBase Reference
100-27-6(CAS DataBase Reference)
NIST Chemistry Reference
Benzeneethanol, 4-nitro-(100-27-6)
EPA Substance Registry System
4-Nitrobenzeneethanol (100-27-6)
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Safety Information

Hazard Codes 
Xi,Xn
Risk Statements 
22-36-40-36/37/38
Safety Statements 
22-24/25-26-36
WGK Germany 
3
RTECS 
SG8602000
Hazard Note 
Irritant
TSCA 
Yes
HS Code 
29062990

MSDS

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4-Nitrobenzeneethanol Usage And Synthesis

Chemical Properties

yellow to orange crystalline powder

Uses

4-Nitro-benzeneethanol is a useful synthetic intermediate. It can be used to synthesize N-phenylethylindole carboxamides as SAR study of allosteric modulators of CB1 receptor. It can also be used to prepare 2-aza-2''-deoxyinosine-containing oligodeoxyribonucleotide duplexes.

Synthesis Reference(s)

The Journal of Organic Chemistry, 38, p. 2786, 1973 DOI: 10.1021/jo00956a011

General Description

Yellow needles (from aqueous methanol) or orange solid.

Air & Water Reactions

Insoluble in water.

Reactivity Profile

A nitrated alcohol. Flammable and/or toxic gases are generated by the combination of alcohols with alkali metals, nitrides, and strong reducing agents. They react with oxoacids and carboxylic acids to form esters plus water. Oxidizing agents convert them to aldehydes or ketones. Alcohols exhibit both weak acid and weak base behavior. They may initiate the polymerization of isocyanates and epoxides.

Health Hazard

SYMPTOMS: Structurally similar chemicals may cause methemoglobinemia.

Fire Hazard

Flash point data for 4-Nitrobenzeneethanol are not available; however, 4-Nitrobenzeneethanol is probably combustible.

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