5-(4-Fluorophenyl)isoxazole-3-methanol - CAS 640291-97-0

Catalog:	BB032346
Product Name:	5-(4-Fluorophenyl)isoxazole-3-methanol
CAS:	640291-97-0
Synonyms:	[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methanol

Technical Data

Patents

Computed Properties

IUPAC Name:	[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methanol
Description:	5-(4-Fluorophenyl)isoxazole-3-methanol (CAS# 640291-97-0) is a useful research chemical.
Molecular Weight:	193.17
Molecular Formula:	C10H8FNO2
Canonical SMILES:	C1=CC(=CC=C1C2=CC(=NO2)CO)F
InChI:	InChI=1S/C10H8FNO2/c11-8-3-1-7(2-4-8)10-5-9(6-13)12-14-10/h1-5,13H,6H2
InChI Key:	PALZYEIQXXRYMW-UHFFFAOYSA-N
Boiling Point:	358.5 °C at 760 mmHg
Melting Point:	79-84 °C (lit.)
Purity:	95 %
Density:	1.298 g/cm³
Appearance:	White powder
MDL:	MFCD06798098
LogP:	1.97300

Publication Number	Title	Priority Date
JP-2019201631-A	Synthesis of therapeutic microvesicles and stem cells	20180126
US-2021054344-A1	Cpc exosomes mirna373 combination therapies	20180126
US-2018273906-A1	Microvesicle and stem cell compositions for therapeutic applications	20140417
EP-2760833-A1	Pyridine derivatives	20110930
JP-2014528413-A	Pyridine derivatives	20110930

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Complexity:	183
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	193.05390666
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	193.05390666
Rotatable Bond Count:	2
Topological Polar Surface Area:	46.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3