2-Methyl-4-nitrophenol
- CAS NO.:99-53-6
- Empirical Formula: C7H7NO3
- Molecular Weight: 153.14
- MDL number: MFCD01734013
- EINECS: 202-763-7
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-08-26 21:18:56
What is 2-Methyl-4-nitrophenol?
Chemical properties
white crystals
The Uses of 2-Methyl-4-nitrophenol
2-Methyl-4-nitrophenol is suitable as a target compound in the study on measurement of methylnitrophenol concentrations and stable isotope ratios in the atmospheric particulate matter and as an internal standard in the determination of monoaromatic nitro compounds in atmospheric aerosols using high performance liquid chromatography electrospray tandem mass spectrometry (HPLC/ESI-MS/MS) method.
It may be used as starting material in the synthesis of 2-bromo-4-nitro-6-methylphenol.
Preparation
2-methyl-4-nitrophenol is prepared by the reaction of 2-methyl-4-nitroaniline with sodium hydroxide and hydrochloric acid.
General Description
2-Methyl-4-nitrophenol is a nitrophenol derivative. The study of its crystal structure reveals the molecule to be nearly planar. Its synthesis has been reported. FT-IR and FT-Raman spectra and molecular modeling of 2-methyl-4-nitrophenol have been analyzed. It is reported to be one of the compounds in diesel exhaust particles (DEP) that shows potential vasodilatation activity in rats. Its reduction catalyzed by porous carbon-encapsulated gold nanoparticles has been investigated.
Properties of 2-Methyl-4-nitrophenol
Melting point: | 93-98 °C(lit.) |
Boiling point: | 266.03°C (rough estimate) |
Density | 1.2744 (estimate) |
refractive index | 1.5744 (estimate) |
storage temp. | Inert atmosphere,Room Temperature |
form | Solid |
pka | 7.43±0.22(Predicted) |
color | Off-White |
InChI | InChI=1S/C7H7NO3/c1-5-4-6(8(10)11)2-3-7(5)9/h2-4,9H,1H3 |
CAS DataBase Reference | 99-53-6(CAS DataBase Reference) |
EPA Substance Registry System | Phenol, 2-methyl-4-nitro- (99-53-6) |
Safety information for 2-Methyl-4-nitrophenol
Signal word | Warning |
Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H302:Acute toxicity,oral H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P270:Do not eat, drink or smoke when using this product. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 2-Methyl-4-nitrophenol
InChIKey | KDQPMQNHVQVVMR-UHFFFAOYSA-N |
SMILES | C1(O)=CC=C([N+]([O-])=O)C=C1C |
Abamectin manufacturer
SRIKAR Labs
BASR Fine Chemicals Pvt. Ltd.
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