5-Fluoro-2-nitrobenzyl Alcohol - CAS 287121-32-8

Catalog:	BB019922
Product Name:	5-Fluoro-2-nitrobenzyl Alcohol
CAS:	287121-32-8
Synonyms:	(5-fluoro-2-nitrophenyl)methanol; (5-fluoro-2-nitrophenyl)methanol

Technical Data

Patents

Computed Properties

IUPAC Name:	(5-fluoro-2-nitrophenyl)methanol
Description:	5-Fluoro-2-nitrobenzyl Alcohol (CAS# 287121-32-8) is a useful research chemical.
Molecular Weight:	171.13
Molecular Formula:	C7H6FNO3
Canonical SMILES:	C1=CC(=C(C=C1F)CO)[N+](=O)[O-]
InChI:	InChI=1S/C7H6FNO3/c8-6-1-2-7(9(11)12)5(3-6)4-10/h1-3,10H,4H2
InChI Key:	CWOZQRGVHQIIJL-UHFFFAOYSA-N
Boiling Point:	286.1 °C at 760 mmHg
Density:	1.434 g/cm³
LogP:	1.74940

Publication Number	Title	Priority Date
EP-3664213-A2	Electrolyte for lithium metal battery and lithium metal battery comprising same	20171017
KR-20190043087-A	Electrolyte for lithium metal battery and lithium metal battery comprising thereof	20171017
US-2020203759-A1	Electrolyte for lithium metal battery and lithium metal battery comprising same	20171017
WO-2019078526-A2	Electrolytes for lithium metal batteries and lithium metal batteries containing the same	20171017
JP-2020532081-A	Electrolytes for lithium metal batteries and lithium metal batteries containing them	20171017

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Complexity:	171
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	171.03317122
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	171.03317122
Rotatable Bond Count:	1
Topological Polar Surface Area:	66
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1