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ChemicalBook--->CAS DataBase List--->5190-68-1

5190-68-1

5190-68-1 Structure

5190-68-1 Structure
IdentificationMore
[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 PropertiesBack 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)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

25-37/38-41
[Safety Statements ]

26-39-45
[RIDADR ]

UN 2811
[WGK Germany ]

3
[HazardClass ]

IRRITANT
[HS Code ]

2933998090
Raw materials And Preparation ProductsBack 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 InformationBack Directory
[Uses]

4-Chloroquinazoline can be used to prepare agricultural fungicides.
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

5190-68-1(sigmaaldrich)
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