2-(3,4-Dimethylphenyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one | CAS No. 277299-70-4

2-(3,4-Dimethylphenyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one

Basic Information

CAS Number

277299-70-4

Molecular Formula

C12H14N2O

Molecular Weight

202.26 g/mol

AD

Basic Physical Properties

Melting Point

121.0 to 125.0 deg-C

Boiling Point

338.5±52.0°C at 760 mmHg

CC1=C(C=C(C=C1)N2C(=O)C=C(N2)C)C

InChI

InChI=1S/C12H14N2O/c1-8-4-5-11(6-9(8)2)14-12(15)7-10(3)13-14/h4-7,13H,1-3H3

InChIKey

HBWBJCSXUJIDGN-UHFFFAOYSA-N

LogP

2.09086

Topological Polar Surface Area

37.79 Ų

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

298

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • D5064
  • 2-(3,4-dimethylphenyl)-5-methyl-1H-pyrazol-3-one
  • A854844
  • 2AK83UFD4X
  • DTXSID90471326
  • AS-19752
  • 2-(3,4-Dimethyl-phenyl)-5-methyl-1,2-dihydro-pyrazol-3-one
  • HBWBJCSXUJIDGN-UHFFFAOYSA-N
  • AKOS002278983
  • 1-(3,4-dimethylphenyl)-3-methyl-1H-pyrazol-5-ol
  • 1-(3,4-Dimethylphenyl)-3-methyl-5-pyrazolone
  • FT-0689793
  • 2-(3,4-dimethylphenyl)-5-methyl-1H-pyrazol-3(2H)-one
  • 2-(3,4-Dimethylphenyl)-1,2-dihydro-5-methyl-3H-pyrazol-3-one
  • 2-(3,4-Dimethylphenyl)-5-methyl- 1H-pyrazol-3(2H)-one
  • 3H-Pyrazol-3-one, 2-(3,4-dimethylphenyl)-1,2-dihydro-5-methyl-
  • 2-(3,4-dimethylphenyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one
  • SCHEMBL407942
  • MFCD09795980
  • CLA29970
  • AC-24708
  • CS-0153002
  • UNII-2AK83UFD4X
  • AKOS025394595
  • SCHEMBL407138
  • 2-(3,4-dimethylphenyl)-5-methyl-2,3-dihydro-1H-pyrazol-3-one
  • NZIOWLDKKHIQHG-UHFFFAOYSA-N
  • J-503088
  • FT-0703365
  • 277299-70-4
  • 925633-57-4

MDL Number

MFCD09795980

FAQ

What regulatory guidelines apply to 2-(3,4-Dimethylphenyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one (CAS: 277299-70-4)?

This compound falls under the regulatory guidelines of the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the European Union, and FDA/EPA requirements for chemical products. Specific handling, storage, and disposal guidelines must be followed based on its classification as a chemical substance.

Are there alternatives to 2-(3,4-Dimethylphenyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one (CAS: 277299-70-4) in synthesis?

Several alternatives can be used in synthesis, including similar pyrazole derivatives or other heterocyclic compounds. Common substitutes include 2-(3,5-dimethylphenyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one, and other 3,4-dimethyl derivatives, which may offer comparable chemical properties.

What is the market or research trend for 2-(3,4-Dimethylphenyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one (CAS: 277299-70-4)?

The market trend for this compound indicates increasing research interest due to its potential applications in pharmaceuticals and materials science. Recent studies focus on its use as a potential drug candidate and as a precursor in synthetic chemistry, with growing demand expected in the coming years.

How should waste containing 2-(3,4-Dimethylphenyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one (CAS: 277299-70-4) be handled?

Waste containing this compound should be collected and stored in appropriate containers, labeled as hazardous. It should be disposed of through professional waste disposal services, ensuring compliance with local regulations. Incineration or other controlled disposal methods should be used, with due consideration to environmental protection measures to minimize any potential environmental impact.

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