CAS No.6484-25-9,4-CHLORO-2-PHENYLQUINAZOLINE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	6484-25-9
Name:	4-CHLORO-2-PHENYLQUINAZOLINE
Article Data:	54

Formula:	C₁₄H₉ClN₂
Molecular Weight:	240.692
Synonyms:	2-Phenyl-4-chloroquinazoline;4-Chloro-2-phenyl-quinazoline;4-Chloro-2-phenylquinazoline;
EINECS:	229-346-2
Density:	1.285 g/cm³
Melting Point:	124-126 °C(lit.)
Boiling Point:	301.218 °C at 760 mmHg
Flash Point:	164.36 °C
Appearance:	slightly yellow to yellow crystalline powder
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	37/39-26
PSA:	25.78000
LogP:	3.95020

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Specification

The Quinazoline,4-chloro-2-phenyl-, with the CAS registry number 6484-25-9, is also known as 4-Chloro-2-phenyl-quinazoline. Its EINECS registry number is 229-346-2. This chemical's molecular formula is C₁₄H₉ClN₂ and molecular weight is 240.69. What's more, both its IUPAC name and systematic name are the same which is called 4-Chloro-2-phenylquinazoline. It should be stored in a cool, dry and well-ventilated place.

Physical properties about Quinazoline,4-chloro-2-phenyl- are: (1)ACD/LogP: 4.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.47; (4)ACD/LogD (pH 7.4): 4.47; (5)ACD/BCF (pH 5.5): 1469.58; (6)ACD/BCF (pH 7.4): 1469.60; (7)ACD/KOC (pH 5.5): 6436.85; (8)ACD/KOC (pH 7.4): 6436.95; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 25.78 Å²; (13)Index of Refraction: 1.668; (14)Molar Refractivity: 69.765 cm³; (15)Molar Volume: 187.232 cm³; (16)Polarizability: 27.657×10^-24cm³; (17)Surface Tension: 54.461 dyne/cm; (18)Density: 1.286 g/cm³; (19)Flash Point: 164.36 °C; (20)Enthalpy of Vaporization: 51.97 kJ/mol; (21)Boiling Point: 301.218 °C at 760 mmHg; (22)Vapour Pressure: 0.002 mmHg at 25 °C.

Preparation of Quinazoline,4-chloro-2-phenyl-: this chemical can be prepared by 2-phenyl-3H-quinazolin-4-one. This reaction needs reagents POCl₃ and PCl₅ at temperature of 130 °C.

Quinazoline,4-chloro-2-phenyl- can be prepared by 2-phenyl-3H-quinazolin-4-one.

Uses of Quinazoline,4-chloro-2-phenyl-: it is used to produce other chemicals. For example, it can react with furfural to get furan-2-yl-(2-phenyl-quinazolin-4-yl)-methanone. The reaction occurs with reagents 1,3-dimethylbenzimidazolium iodide, NaH and solvent dimethylformamide at temperature of 80 °C. The reaction time is 10 min. The yield is 67 %.

Quinazoline,4-chloro-2-phenyl- can react with furfural to get furan-2-yl-(2-phenyl-quinazolin-4-yl)-methanone.

When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes. And it is irritating to eyes, respiratory system and skin. Therefore, you should wear gloves and eye/face protection. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc2nc(nc1c2cccc1)c3ccccc3
(2) InChI: InChI=1S/C14H9ClN2/c15-13-11-8-4-5-9-12(11)16-14(17-13)10-6-2-1-3-7-10/h1-9H
(3) InChIKey: OBHKONRNYCDRKM-UHFFFAOYSA-N