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452-72-2

452-72-2 Structure

452-72-2 Structure
IdentificationMore
[Name]

4-Fluoro-2-methylphenol
[CAS]

452-72-2
[Synonyms]

2-METHYL-4-FLUOROPHENOL
4-FLUORO-2-METHYLPHENOL
4-FLUORO-O-CRESOL
4-Fluoro-o-methylphenol
4-Fluoro-2-methylphenol 99%
4-Fluoro-2-methylphenol99%
[EINECS(EC#)]

207-209-8
[Molecular Formula]

C7H7FO
[MDL Number]

MFCD00075088
[Molecular Weight]

126.13
[MOL File]

452-72-2.mol
Chemical PropertiesBack Directory
[Appearance]

Off-white to brownish low melting solid or liquid
[Melting point ]

37-38 °C (lit.)
[Boiling point ]

87 °C/14 mmHg (lit.)
[density ]

1.1514 (estimate)
[refractive index ]

1.5155-1.5175
[Fp ]

185 °F
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

Low Melting Solid or Liquid
[pka]

10.32±0.18(Predicted)
[color ]

Off-white to brownish
[Water Solubility ]

Insoluble in water.
[BRN ]

2041490
[InChI]

InChI=1S/C7H7FO/c1-5-4-6(8)2-3-7(5)9/h2-4,9H,1H3
[InChIKey]

GKQDDKKGDIVDAG-UHFFFAOYSA-N
[SMILES]

C1(O)=CC=C(F)C=C1C
[CAS DataBase Reference]

452-72-2(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R21/22:Harmful in contact with skin and if swallowed .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

UN 1325 4.1/PG 2
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

8
[HazardClass ]

IRRITANT
[HS Code ]

29081990
Hazard InformationBack Directory
[Chemical Properties]

Off-white to brownish low melting solid or liquid
[Uses]

4-Fluoro-2-methylphenol is an important raw material and intermediate used in organic synthesis, pharmaceuticals agrochemicals and dyestuff fields.
[General Description]

Laccase mediated grafting of 4-fluoro-2-methylphenol with lignin model compound, dibenzodioxocin and lignocellulose material has been investigated.
[Synthesis]

Add 70g of water and 26g of concentrated sulfuric acid to the 250mL reaction flask (pay attention to exothermic, add concentrated sulfuric acid to water slowly, the same below), add 17.5g of 4-fluoro-2-methylaniline at room temperature while stirring, a w
[References]

[1] Tetrahedron Letters, 2011, vol. 52, # 41, p. 5338 - 5341
Spectrum DetailBack Directory
[Spectrum Detail]

4-Fluoro-2-methylphenol(452-72-2)MS
4-Fluoro-2-methylphenol(452-72-2)1HNMR
4-Fluoro-2-methylphenol(452-72-2)13CNMR
4-Fluoro-2-methylphenol(452-72-2)IR1
4-Fluoro-2-methylphenol(452-72-2)IR2
4-Fluoro-2-methylphenol(452-72-2)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Fluoro-2-methylphenol, 98%(452-72-2)
[Alfa Aesar]

4-Fluoro-2-methylphenol, 98%(452-72-2)
[Sigma Aldrich]

452-72-2(sigmaaldrich)
[TCI AMERICA]

4-Fluoro-o-cresol,>98.0%(GC)(452-72-2)
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