1-Bromo-2,4,6-trifluorobenzene - CAS 2367-76-2

Catalog:	BB018136
Product Name:	1-Bromo-2,4,6-trifluorobenzene
CAS:	2367-76-2
Synonyms:	2-bromo-1,3,5-trifluorobenzene

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-bromo-1,3,5-trifluorobenzene
Description:	1-Bromo-2,4,6-trifluorobenzene (CAS# 2367-76-2) is a useful research chemical.
Molecular Weight:	210.98
Molecular Formula:	C6H2BrF3
Canonical SMILES:	C1=C(C=C(C(=C1F)Br)F)F
InChI:	InChI=1S/C6H2BrF3/c7-6-4(9)1-3(8)2-5(6)10/h1-2H
InChI Key:	PZBSPSOGEVCRQI-UHFFFAOYSA-N
Boiling Point:	141 °C
Purity:	98 %
Density:	1.79 g/cm³
Appearance:	Clear colorless liquid
MDL:	MFCD00000334
LogP:	2.86640

Publication Number	Title	Priority Date
WO-2021127404-A1	Tricyclic pyridones and pyrimidones	20191220
US-2021188789-A1	Isoxazoline derivatives	20191218
WO-2021127188-A1	Isoxazoline derivatives as pesticides	20191218
CN-112538072-A	Novel aminopyrimidine EGFR (epidermal growth factor receptor) inhibitor	20190921
EP-3771737-A1	Organic molecules in particular for use in optoelectronic devices	20190730

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Other Pyrimidines

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GHS Hazard Statement:	H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501
Signal Word:	Warning

Complexity:	108
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	209.92920
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	209.92920
Rotatable Bond Count:	0
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9