5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde

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5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde Basic information
Product Name:5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde
Synonyms:5-CHLORO-3-METHYL-1-PHENYL-4-PYRAZOLECARBOXALDEHYDE;5-CHLORO-3-METHYL-1-PHENYL PYRAZOLE-4-ALDEHYDE;5-CHLORO-3-METHYL-1-PHENYLPYRAZOLE-4-CARBALDEHYDE;5-CHLORO-3-METHYL-1-PHENYLPYRAZOLE-4-CARBOXALDEHYDE;5-CHLORO-4-FORMYL-3-METHYL-1-PHENYLPYRAZOLE;OTAVA-BB BB0111070359;AKOS BBS-00001388;AKOS B018718
CAS:947-95-5
MF:C11H9ClN2O
MW:220.65
EINECS:
Product Categories:Building Blocks;Halogenated Heterocycles;Heterocyclic Building Blocks;Pyrazoles;PyrazolesHeterocyclic Building Blocks
Mol File:947-95-5.mol
5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde Structure
5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde Chemical Properties
Melting point 145-148 °C (lit.)
Boiling point 356.1±37.0 °C(Predicted)
density 1.26
refractive index 1.6000 (estimate)
storage temp. under inert gas (nitrogen or Argon) at 2-8°C
pka-3.81±0.10(Predicted)
form powder to crystal
color White to Light yellow
InChIInChI=1S/C11H9ClN2O/c1-8-10(7-15)11(12)14(13-8)9-5-3-2-4-6-9/h2-7H,1H3
InChIKeyDKZPJLZXLKAMDO-UHFFFAOYSA-N
SMILESN1(C2=CC=CC=C2)C(Cl)=C(C=O)C(C)=N1
CAS DataBase Reference947-95-5(CAS DataBase Reference)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-36
WGK Germany 3
HazardClass IRRITANT
HS Code 29331990
Storage Class11 - Combustible Solids
Hazard ClassificationsEye Irrit. 2
Skin Irrit. 2
STOT SE 3
MSDS Information
ProviderLanguage
SigmaAldrich English
ACROS English
5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde Usage And Synthesis
Chemical Propertieslight yellow to yellow flakes or needles
Uses5-Chloro-3-methyl-1-phenyl-4-pyrazolecarboxaldehyde (5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carboxaldehyde) may be employed as starting material for the following syntheses:
  • 5-chloro-3-methyl-1-phenyl-1H-pyrazole-4-carboxaldehyde hydrazone
  • N1-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)thiosemicarbazone
  • pyrazole derivatives, which were pharmacologically evaluated for analgesic (tail flick) and anti-inflammatory (based on carrageenan-induced paw edema) activities
  • N′-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4- yl)methylene] 2/4-substituted hydrazides
General Description5-Chloro-3-methyl-1-phenyl-4-pyrazolecarboxaldehyde (5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carboxaldehyde) can be synthesized from 3-methyl-1-phenyl-1Hpyrazol-5(4H)-one under Vilsmeier-Haack reaction conditions. Knoevenagel condensation of 5-chloro-3-methyl-1-phenyl-1H-pyrazole-4-carboxaldehyde with ethylcyanoacetate at 0°C has been reported to afford ethyl-2-cyano-3-(5-chloro-3-methyl-1-phenyl-1H-pyrazole-4-yl)propionate. It participates in the synthesis of 2-((5-phenoxy-3-methyl-1-phenyl-1H-pyrazol- 4-yl)methylene)hydrazinecarbothiomide derivatives with a potential anticonvulsant property.
5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde Preparation Products And Raw materials
Preparation Products1H-Thieno[2,3-c]pyrazole, 3-methyl-1-phenyl--->3-Methyl-5-morpholin-4-yl-1-phenyl-1H-pyrazole-4-carbaldehyde-->3-Methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carboxylic acid
Tag:5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde(947-95-5) Related Product Information
1-Phenylpyrazole 1H-Pyrazole-4-carboxaldehyde 5-Chloro-3-methyl-1-phenylpyrazole 5-Chloro-3-methyl-1-p-tolyl-1H-pyrazole-4-carboxaldehyde 3-Methyl-1-phenylpyrazole 5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde 5-Chloro-3-methyl-1-phenyl-1H-pyrazole-4-carboxylic acid 5-Chloro-1-(2-chlorophenyl)-3-methyl-1H-pyrazole-4-carboxaldehyde Methyl 5-chloro-4-formyl-1-phenyl-1H-pyrazole-3-carboxylate 5-Chloro-1-methyl-3-phenyl-1H-pyrazole-4-carbaldehyde 5-Chloro-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carboxaldehyde 5-Chloro-1,3-diphenyl-1H-pyrazole-4-carbaldehyde SALOR-INT L172332-1EA AKOS B004301 LABOTEST-BB LTBB005462 SALOR-INT L172375-1EA 5-Chloro-1-phenyl-3-(trifluoromethyl)-1H-pyrazole-4-carbaldehyde 5-Chloro-3-[2-(dimethylamino)-1-formylvinyl]-1-phenyl-1H-pyrazole-4-carboxaldehyde