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CAS No.: | 17518-98-8 |
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Name: | 7-Bromo-6-chloro-4-quinazolinone |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C8H4BrClN2O |
Molecular Weight: | 259.49 |
Synonyms: | 4(1H)-Quinazolinone,7-bromo-6-chloro- (9CI);7-Bromo-6-chloro-4(3H)-quinazolinone; |
Density: | 1.95 g/cm3 |
Melting Point: | >300 °C |
Boiling Point: | 481.8 °C at 760 mmHg |
Flash Point: | 245.2 °C |
Appearance: | yellow-brown solid |
PSA: | 45.75000 |
LogP: | 2.33900 |
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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%.