3-Bromo-4-chloro-2-fluorobenzyl Alcohol - CAS 1824057-69-3

Catalog:	BB013977
Product Name:	3-Bromo-4-chloro-2-fluorobenzyl Alcohol
CAS:	1824057-69-3
Synonyms:	(3-bromo-4-chloro-2-fluorophenyl)methanol; (3-bromo-4-chloro-2-fluorophenyl)methanol

Technical Data

Patents

Computed Properties

IUPAC Name:	(3-bromo-4-chloro-2-fluorophenyl)methanol
Description:	3-Bromo-4-chloro-2-fluorobenzyl Alcohol (CAS# 1824057-69-3) is a useful research chemical.
Molecular Weight:	239.47
Molecular Formula:	C7H5BrClFO
Canonical SMILES:	C1=CC(=C(C(=C1CO)F)Br)Cl
InChI:	InChI=1S/C7H5BrClFO/c8-6-5(9)2-1-4(3-11)7(6)10/h1-2,11H,3H2
InChI Key:	ZTRDPYMNGHIYHD-UHFFFAOYSA-N
LogP:	2.73390

Publication Number	Title	Priority Date
AU-2016274694-A1	Aminobenzisoxazole compounds as agonists of A7-nicotinic acetylcholine receptors	20150610
CA-2988968-A1	Aminobenzisoxazole compounds as agonists of a7-nicotinic acetylcholine receptors	20150610
EP-3307269-A1	Aminobenzisoxazole compounds as agonists of a7-nicotinic acetylcholine receptors	20150610
JP-2018516973-A	Aminobenzisoxazole compounds as agonists of Î±7-nicotinic acetylcholine receptors	20150610
KR-20180044256-A	Aminobenzoisooxazole compounds as agonists of the A7-nicotinic acetylcholine receptor	20150610

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Complexity:	136
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	237.91963
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	237.91963
Rotatable Bond Count:	1
Topological Polar Surface Area:	20.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5