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4(3H)-Quinazolinone,7-bromo-6-chloro- (17518-98-8)

Identification
Name:4(3H)-Quinazolinone,7-bromo-6-chloro-
Synonyms:4(1H)-Quinazolinone,7-bromo-6-chloro- (9CI);7-Bromo-6-chloro-4(3H)-quinazolinone;
CAS:17518-98-8
Molecular Formula: C8H4BrClN2O
Molecular Weight: 259.49
InChI: InChI=1/C8H4BrClN2O/c9-5-2-7-4(1-6(5)10)8(13)12-3-11-7/h1-3H,(H,11,12,13)
Molecular Structure: (C8H4BrClN2O) 4(1H)-Quinazolinone,7-bromo-6-chloro- (9CI);7-Bromo-6-chloro-4(3H)-quinazolinone;
Properties
Density:1.95
Refractive index:1.737
Appearance:yellow-brown solid
Specification:

  7-Bromo-6-chloro-4-quinazolinone , with cas registry number of 17518-98-8, is also called 7-Bromo-6-chloro-4(3H)-quinazolinone . Its systematic name is called 7-bromo-6-chloroquinazolin-4(3H)-one with SMILES of Clc1cc2c(cc1Br)/N=C\NC2=O based on its molecular structure. Other structure descriptions also include (1) InChI: InChI=1/C8H4BrClN2O/c9-5-2-7-4(1-6(5)10)8(13)12-3-11-7/h1-3H,(H,11,12,13); (2) InChIKey: RFCXXKWROOFQSI-UHFFFAOYAJ. According to its molecular structure, this compound can be classified to the product categories of Heterocycles; Aromatics Compounds; Aromatics.

  The physical properties about 7-Bromo-6-chloro-4-quinazolinone include: (1) H bond acceptors: 3; (2) H bond donors: 1; (3) Freely Rotating Bonds: 0; (4) Index of Refraction: 1.737; (5) Molar Refractivity: 53.42 cm3; (6) Molar Volume: 132.8 cm3; (7) Surface Tension: 60.9 dyne/cm; (8) Enthalpy of Vaporization: 74.65 kJ/mol; (9) Vapour Pressure: 1.94E-09 mmHg at 25°C.

 7-Bromo-6-chloro-4-quinazolinone can be obtained in the market from the suppliers such as Qingdao Vochem Co., Ltd., and Nanjing Trihedron Chemical Technology Co., Ltd.. The content is usually 98%.

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