| Identification | More | [Name]
4-Nitrobenzeneethanol | [CAS]
100-27-6 | [Synonyms]
2-(4-NITROPHENYL)ETHANOL
2-(4-NITROPHENYL)ETHYL ALCOHOL
2-(p-Nitrophenyl)ethanol
3,5-DIMETHOXY-4-HYDROXYBENZOIC ACID
4-nitrobenzeneethanol
4-NITROPHENETHYL ALCOHOL
AKOS 90322
AURORA KA-7063
BETA-(P-NITROPHENYL)ETHANOL
P-NITROPHENETHYL ALCOHOL
4-nitro-benzeneethano
Phenethyl alcohol, p-nitro-
p-nitro-phenethylalcoho
beta-(p-Nitrophenyl)alcohol
β-P-nitrophenylenthanol
SS-P-NITROPHENYLENTHANOL
SS-P-NITROPHENYLETHANOL
PARA-NITROPHENETHYLALCOHOL
p-Nitrophenylethanol
4-NITROBENETHYL ALCOHOL | [EINECS(EC#)]
202-835-8 | [Molecular Formula]
C8H9NO3 | [MDL Number]
MFCD00010202 | [Molecular Weight]
167.16 | [MOL File]
100-27-6.mol |
| Chemical Properties | Back Directory | [Appearance]
yellow to orange crystalline powder | [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 | [Stability:]
Stable. Combustible. Incompatible with strong oxidizing agents, strong bases. | [Water Solubility ]
<0.01 g/100 mL at 18 ºC | [BRN ]
1866148 | [CAS DataBase Reference]
100-27-6(CAS DataBase Reference) | [NIST Chemistry Reference]
Benzeneethanol, 4-nitro-(100-27-6) | [EPA Substance Registry System]
100-27-6(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi,Xn | [Risk Statements ]
R22:Harmful if swallowed.
R36:Irritating to the eyes.
R40:Limited evidence of a carcinogenic effect.
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing . | [WGK Germany ]
3
| [RTECS ]
SG8602000
| [Hazard Note ]
Irritant | [TSCA ]
Yes | [HS Code ]
29062990 |
| Hazard Information | Back Directory | [General Description]
Yellow needles (from aqueous methanol) or orange solid. | [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. | [Air & Water Reactions]
Insoluble in water. | [Health Hazard]
SYMPTOMS: Structurally similar chemicals may cause methemoglobinemia. | [Fire Hazard]
Flash point data for this chemical are not available; however, P-NITROPHENETHYL ALCOHOL(100-27-6) is probably combustible. | [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 |
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