5190-68-1

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5190-68-1 Structure

Identification	More
[Name] 4-CHLORO-QUINAZOLINE
[CAS] 5190-68-1
[Synonyms] 4-CHLORO-QUINAZOLINE AKOS BBS-00004561
[Molecular Formula] C8H5ClN2
[MDL Number] MFCD00228682
[Molecular Weight] 164.59
[MOL File] 5190-68-1.mol

Chemical Properties	Back Directory
[Melting point ] 96-100 °C
[Boiling point ] 281.0±13.0 °C(Predicted)
[density ] 1.349±0.06 g/cm3(Predicted)
[storage temp. ] Inert atmosphere,2-8°C
[solubility ] MeOH
[form ] Solid
[pka] 0.83±0.30(Predicted)
[color ] Off-White
[InChI] InChI=1S/C8H5ClN2/c9-8-6-3-1-2-4-7(6)10-5-11-8/h1-5H
[InChIKey] GVRRXASZZAKBMN-UHFFFAOYSA-N
[SMILES] N1=C2C(C=CC=C2)=C(Cl)N=C1
[CAS DataBase Reference] 5190-68-1(CAS DataBase Reference)

Raw materials And Preparation Products	Back Directory
[Raw materials] Ammonium hydroxide-->Phosphorus pentachloride-->Anthranilic acid-->Quinazoline-->4-Hydroxyquinazoline
[Preparation Products] 4-(P-HYDROXYANILINO)QUINAZOLINE-->QUINAZOLIN-4-YLAMINE-->2-[(quinazolin-4-yl)amino]ethan-1-ol-->1-QUINAZOLIN-4-YL-PIPERIDINE-4-CARBOXYLIC ACID-->1-(4-QUINAZOLINYL)-4-PIPERIDINAMINE-->tert-Butyl N-[1-(quinazolin-4-yl)piperidin-4-yl]carbamate

Hazard Information	Back Directory
[Uses] 4-Chloroquinazoline can be used to prepare agricultural fungicides.

Well-known Reagent Company Product Information	Back Directory
[Sigma Aldrich] 5190-68-1(sigmaaldrich)

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