3-Fluoroazetidine-1-ethanamine - CAS 2045189-35-1

Catalog:	BB015984
Product Name:	3-Fluoroazetidine-1-ethanamine
CAS:	2045189-35-1
Synonyms:	2-(3-fluoro-1-azetidinyl)ethanamine; 2-(3-fluoroazetidin-1-yl)ethanamine

Technical Data

Patents

Computed Properties

IUPAC Name:	2-(3-fluoroazetidin-1-yl)ethanamine
Description:	3-Fluoroazetidine-1-ethanamine (CAS# 2045189-35-1 ) is a useful research chemical.
Molecular Weight:	118.15
Molecular Formula:	C5H11FN2
Canonical SMILES:	C1C(CN1CCN)F
InChI:	InChI=1S/C5H11FN2/c6-5-3-8(4-5)2-1-7/h5H,1-4,7H2
InChI Key:	ZVOBAJVTRLDBGM-UHFFFAOYSA-N

Publication Number	Title	Priority Date
US-2016333009-A1	Benzimidazole and imadazopyridine carboximidamide compounds	20150515
US-9951065-B2	Benzimidazole and imadazopyridine carboximidamide compounds	20150515
WO-2014023367-A1	Carboxamide or sulfonamide substituted nitrogen-containing 5-membered heterocycles as modulators for the orphan nuclear receptor ror gamma	20120809
US-2015175562-A1	Carboxamide or sulfonamide substituted thiazoles and related derivatives as modulators for the orphan nuclear receptor ror[gamma]	20120531
WO-2013178362-A1	Carboxamide or sulfonamide substituted thiazoles and related derivatives as modulators for the orphan nuclear receptor ror[gamma]	20120531

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Complexity:	70.8
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	118.09062652
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	118.09062652
Rotatable Bond Count:	2
Topological Polar Surface Area:	29.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.5