ChemicalBook--->CAS DataBase List--->959237-68-4

959237-68-4

959237-68-4 Structure

959237-68-4 Structure
IdentificationBack Directory
[Name]

2,4-DICHLORO-7-BROMOQUINAZOLINE
[CAS]

959237-68-4
[Synonyms]

2,4-DICHLORO-7-BROMOQUINAZOLINE
7-Bromo-2,4-dichloroquinazoline
Quinazoline, 7-bromo-2,4-dichloro-
[Molecular Formula]

C8H3BrCl2N2
[MDL Number]

MFCD09954890
[MOL File]

959237-68-4.mol
[Molecular Weight]

277.94
Chemical PropertiesBack Directory
[Boiling point ]

330.2±24.0 °C(Predicted)
[density ]

1.851±0.06 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[pka]

-1.17±0.30(Predicted)
[Appearance]

White to yellow Solid
Safety DataBack Directory
[Symbol(GHS) ]

Health Hazard (GHS08)
GHS08
[Signal word ]

Warning
[Hazard statements ]

H317-H351b-H373
[Precautionary statements ]

P201-P202-P260-P272-P280g-P302+P352-P308+P313-P363-P403-P501c
[HS Code ]

2933599590
Spectrum DetailBack Directory
[Spectrum Detail]

2,4-DICHLORO-7-BROMOQUINAZOLINE(959237-68-4)1HNMR
Hazard InformationBack Directory
[Synthesis]

7-BROMOQUINAZOLINE-2,4(1H,3H)-DIONE

114703-12-7

2,4-DICHLORO-7-BROMOQUINAZOLINE

959237-68-4

The general procedure for the synthesis of 2,4-dichloro-7-bromoquinazoline from 7-bromoquinazoline-2,4(1H,3H)-dione was as follows: 205.0 g (0.84 mol) of 7-bromo-1H-benzo[d]-1,3-oxazine-2,4-dione was suspended in 1.26 L (12.59 mol) of phosphorochloride at room temperature, followed by the addition of 71.34 mL (0.42 mol) N-ethyl diisopropylamine. The reaction mixture was heated to reflux and kept for 36 hours. Upon completion of the reaction, 193.6 g of the target product 7-bromo-2,4-dichloroquinazoline was obtained by a conventional post-processing step. The product was analyzed by HPLC/MS and showed that the (M+H)+ peak was located at 277/279, confirming the solid form.

[References]

[1] Patent: US2013/12489, 2013, A1. Location in patent: Paragraph 0174
[2] Bioorganic and Medicinal Chemistry Letters, 2017, vol. 27, # 21, p. 4904 - 4907
[3] Patent: WO2012/58671, 2012, A1. Location in patent: Page/Page column 92-93
[4] Patent: US2014/38952, 2014, A1. Location in patent: Page/Page column 0160-0161
[5] Antimicrobial Agents and Chemotherapy, 2017, vol. 61, # 6,
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