5-Bromo-3-fluorophenetole - CAS 212307-87-4

Catalog:	BB016719
Product Name:	5-Bromo-3-fluorophenetole
CAS:	212307-87-4
Synonyms:	1-bromo-3-ethoxy-5-fluorobenzene; 1-bromo-3-ethoxy-5-fluorobenzene

Technical Data

Patents

Computed Properties

IUPAC Name:	1-bromo-3-ethoxy-5-fluorobenzene
Description:	5-Bromo-3-fluorophenetole (CAS# 212307-87-4) is a useful research chemical.
Molecular Weight:	219.05
Molecular Formula:	C8H8BrFO
Canonical SMILES:	CCOC1=CC(=CC(=C1)Br)F
InChI:	InChI=1S/C8H8BrFO/c1-2-11-8-4-6(9)3-7(10)5-8/h3-5H,2H2,1H3
InChI Key:	SQLIBVAWDBGNHE-UHFFFAOYSA-N
LogP:	2.98690

Publication Number	Title	Priority Date
WO-2019137201-A1	Heteroarylo tetrahydropyridine compound and preparation method, pharmaceutical composition, and application thereof	20180109
CN-111315744-A	Heteroaryl tetrahydropyridine compound, preparation method thereof, pharmaceutical composition and application thereof	20180109
CN-107556244-B	Fused ring compound, pharmaceutical composition and application thereof	20160701
US-10426168-B2	Agent for controlling noxious arthropods	20150617
US-2018168159-A1	Agent for controlling noxious arthropods	20150617

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Related Functional Groups

Halides

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[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[4860-03-1]
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[56517-33-0]
2-Bromo-4-isopropoxy-5-methoxybenzaldehyde
[1354706-05-0]
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Complexity:	121
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	217.97426
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	217.97426
Rotatable Bond Count:	2
Topological Polar Surface Area:	9.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.1