4-Chloro-6-(1H-imidazol-1-yl)pyrimidine

Base Information

• Chemical Name: 4-Chloro-6-(1H-imidazol-1-yl)pyrimidine
• CAS No.: 114834-02-5
• Molecular Formula: C7H5ClN4
• Molecular Weight: 180.596
• Hs Code.: 2933990090
• European Community (EC) Number: 672-356-0
• DSSTox Substance ID: DTXSID30373971
• Wikidata: Q72452060
• Mol file: 114834-02-5.mol

Synonyms:4-Chloro-6-(1H-imidazol-1-yl)pyrimidine;114834-02-5;4-chloro-6-imidazol-1-ylpyrimidine;4-chloro-6-imidazol-1-yl-pyrimidine;4-chloro-6-(imidazol-1-yl)pyrimidine;6-(imidazol-1-yl)-4-chloropyrimidine;6-chloro-4-(1-imidazolyl)pyrimidine;4-Chloro-6-(1-imidazolyl)pyrimidine;IRGANOX5057;SCHEMBL559293;PYRIMIDINE, 4-CHLORO-6-(1H-IMIDAZOL-1-YL)-;DTXSID30373971;BOBHIPMYQAROLL-UHFFFAOYSA-N;AMY18011;MFCD01631197;STL133221;AKOS005745407;AB09344;AC-6534;AS-38729;BP-10387;CS-0171511;FT-0687235;EN300-76596;J-003140;Z802558694

Chemical Property of 4-Chloro-6-(1H-imidazol-1-yl)pyrimidine

Chemical Property:

• Appearance/Colour: Yellow power
• Vapor Pressure: 2.24E-05mmHg at 25°C
• Melting Point: 131.5-132.0 °C
• Refractive Index: 1.702
• Boiling Point: 371.192 °C at 760 mmHg
• PKA: 3.11±0.10(Predicted)
• Flash Point: 178.291 °C
• PSA: 43.60000
• Density: 1.475 g/cm³
• LogP: 1.31570
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 180.0202739
• Heavy Atom Count: 12
• Complexity: 154

Purity/Quality:

98%,99%, ^*data from raw suppliers

4-Chloro-6-imidazol-1-yl-pyrimidine ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN(C=N1)C2=CC(=NC=N2)Cl