2-(2-Bromo-5-fluorophenyl)ethanamine - CAS 771573-14-9

Catalog:	BB035828
Product Name:	2-(2-Bromo-5-fluorophenyl)ethanamine
CAS:	771573-14-9
Synonyms:	2-(2-bromo-5-fluorophenyl)ethanamine; 2-(2-bromo-5-fluorophenyl)ethanamine

Technical Data

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Computed Properties

IUPAC Name:	2-(2-bromo-5-fluorophenyl)ethanamine
Description:	2-(2-Bromo-5-fluorophenyl)ethanamine (CAS# 771573-14-9 ) is a useful research chemical.
Molecular Weight:	218.07
Molecular Formula:	C8H9BrFN
Canonical SMILES:	C1=CC(=C(C=C1F)CCN)Br
InChI:	InChI=1S/C8H9BrFN/c9-8-2-1-7(10)5-6(8)3-4-11/h1-2,5H,3-4,11H2
InChI Key:	SQTSCCWHQMRJKN-UHFFFAOYSA-N

Publication Number	Title	Priority Date
WO-2021117733-A1	Acrylamide compounds	20191209
AU-2012356076-A1	Heterocyclyl derivatives and their use as prostaglandin D2 receptor modulators	20111221
CA-2858328-A1	Heterocyclyl derivatives and their use as prostaglandin d2 receptor modulators	20111221
EP-2794563-A1	Heterocyclyl derivatives and their use as prostaglandin d2 receptor modulators	20111221
US-2015252036-A1	Heterocyclyl Derivatives and their use as Prostaglandin D2 Receptor Modulators	20111221

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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:	216.99024
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	216.99024
Rotatable Bond Count:	2
Topological Polar Surface Area:	26
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2