(±)-1-(1-Naphthyl)ethanol - CAS 1517-72-2

Catalog:	BB010712
Product Name:	(±)-1-(1-Naphthyl)ethanol
CAS:	1517-72-2
Synonyms:	1-naphthalen-1-ylethanol

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	1-naphthalen-1-ylethanol
Description:	(±)-1-(1-Naphthyl)ethanol (CAS# 1517-72-2) is a useful chemical in organic synthesis.Is used in preparation and catalytic activity of amine(imine)diphosphine Fe complexes for the asymmetric transfer hydrogenation of ketones.
Molecular Weight:	172.22
Molecular Formula:	C12H12O
Canonical SMILES:	CC(C1=CC=CC2=CC=CC=C21)O
InChI:	InChI=1S/C12H12O/c1-9(13)11-8-4-6-10-5-2-3-7-12(10)11/h2-9,13H,1H3
InChI Key:	CDRQOYRPWJULJN-UHFFFAOYSA-N
Boiling Point:	133 °C / 3 mmHg
Density:	1.113 g/cm³
MDL:	MFCD00016806
LogP:	2.89310

Publication Number	Title	Priority Date
CN-113264809-A	Method for preparing alkane by first-order alcohol coupling catalyzed by N-heterocyclic carbene metal compound	20210521
CN-113061264-A	Chiral MOFs material and application thereof as chromatographic stationary phase in chiral drug resolution	20210419
CN-111889087-A	Preparation and application of pyridine ionic liquid functionalized beta-cyclodextrin silica gel chromatographic stationary phase	20200813
CN-111807971-A	Alkylation synthesis method for in-situ catalysis of alcohols	20200709
WO-2021182152-A1	(poly)alkylene-glycol-containing compound	20200312

PMID	Publication Date	Title	Journal
22568686	20120606	Theoretical prediction of selectivity in kinetic resolution of secondary alcohols catalyzed by chiral DMAP derivatives	Journal of the American Chemical Society
21750813	20111001	Effect of terbium(III) on the binding of aromatic guests with sodium taurocholate aggregates	Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology
19850472	20100301	Immobilization of intracellular carbonyl reductase from Geotrichum candidum for the stereoselective reduction of 1-naphthyl ketone	Bioresource technology
19606836	20091215	Effect of the structure of bile salt aggregates on the binding of aromatic guests and the accessibility of anions	Langmuir : the ACS journal of surfaces and colloids
17027259	20070701	Improvement of carbonyl reductase production of Geotrichum candidum for the transformation of 1-acetonaphthone to S(-)-1-(1'-napthyl) ethanol	Bioresource technology

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Complexity:	167
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	172.088815002
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	172.088815002
Rotatable Bond Count:	1
Topological Polar Surface Area:	20.2
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	3