[3-(4-Fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methanol

Basic Information

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CAS Number

1018297-63-6

Molecular Formula

C11H10FNO2

Molecular Weight

207.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

378.549 °C at 760 mmHg

Flash Point

182.74 °C

SMILES

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CC1=C(C(=NO1)C2=CC=C(C=C2)F)CO

InChI

InChI=1S/C11H10FNO2/c1-7-10(6-14)11(13-15-7)8-2-4-9(12)5-3-8/h2-5,14H,6H2,1H3

InChIKey

YTPVTPNVCHCMAT-UHFFFAOYSA-N

LogP

2.281420000000001

Topological Polar Surface Area

46.260000000000005 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

207

Synonyms & References

English

[3-(4-Fluorophenyl)-5-methyl-isoxazole-4-yl]methanol
4-Isoxazolemethanol, 3-(4-fluorophenyl)-5-methyl-
(3-(4-Fluorophenyl)-5-methylisoxazol-4-yl)methanol
CS-0047101
[3-(4-Fluoro-phenyl)-5-methyl-isoxazol-4-yl]-methanol
[3-(4-Fluorophenyl)-5-methylisoxazole-4-yl]methanol
[3-(4-Fluorophenyl)-5-methyl-isoxazol-4-yl]-methanol
DTXSID00651470
W15044
YTPVTPNVCHCMAT-UHFFFAOYSA-N
A897042
4-Isoxazolemethanol,3-(4-fluorophenyl)-5-methyl-
DS-16470
1018297-63-6
[3-(4-fluorophenyl)-5-methyl-4-isoxazolyl]methanol
[3-(4-Fluoro-phenyl)-5-methyl-isoxazole-4-yl]methanol
MFCD10008830
AKOS005255125
FT-0689897
(3-(4-Fluorphenyl)-5-methyl-isoxazol-4-yl)-methanol
AU-004/43508356
SCHEMBL286403
[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methanol
[3-(4-Fluorophenyl)-5-methylisoxazol-4-yl]methanol
3-(4-fluorophenyl)-5-Methyl-4-IsoxazoleMethanol
0482AA
BBL103767
STL557577
PC200510
AX8236745
ST2402293

MDL Number

MFCD10008830

FAQ

What are the physical and chemical properties of [3-(4-Fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methanol (CAS: 1018297-63-6)?

[3-(4-Fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methanol is a white crystalline solid with a molecular weight of approximately 241.22 g/mol. It has a moderate solubility in water (2.8 g/L at 25°C) and is sparingly soluble in organic solvents like ethanol and methanol. Chemically, it is stable under normal conditions but can react with strong bases. It is soluble in methanol, ethanol, and acetone, but insoluble in water.

How is [3-(4-Fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methanol (CAS: 1018297-63-6) typically synthesized?

[3-(4-Fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methanol can be synthesized via a reaction of 4-fluorophenyl methyl ketone with hydroxylamine hydrochloride, followed by reduction. The process involves the use of sodium borohydride as a reducing agent to achieve a high yield. The reaction is carried out under mild conditions, and the product is purified by recrystallization from ethanol.

What industries use [3-(4-Fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methanol (CAS: 1018297-63-6)?

[3-(4-Fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methanol finds applications in the pharmaceutical industry, particularly in the synthesis of certain medicinal compounds. It is also used in the chemical industry for the development of new materials, such as polymers and sensors, due to its unique structural features.

What precautions should be taken when handling [3-(4-Fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methanol (CAS: 1018297-63-6)?

When handling [3-(4-Fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methanol, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Keep the compound away from sources of heat and direct sunlight. Store it in a well-ventilated area, preferably in a fume hood. In case of a spill, use appropriate containment and clean up materials to avoid environmental contamination. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information.