2-(1-Hydroxyethyl)pyridine - CAS 18728-61-5

Catalog:	BB014413
Product Name:	2-(1-Hydroxyethyl)pyridine
CAS:	18728-61-5
Synonyms:	1-(2-pyridinyl)ethanol; 1-pyridin-2-ylethanol

Technical Data

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Computed Properties

IUPAC Name:	1-pyridin-2-ylethanol
Description:	2-(1-Hydroxyethyl)pyridine (CAS# 18728-61-5) is a useful research chemical.
Molecular Weight:	123.15
Molecular Formula:	C7H9NO
Canonical SMILES:	CC(C1=CC=CC=N1)O
InChI:	InChI=1S/C7H9NO/c1-6(9)7-4-2-3-5-8-7/h2-6,9H,1H3
InChI Key:	PPHIIIRFJKDTLG-UHFFFAOYSA-N
Boiling Point:	210.6 °C at 760 mmHg
Density:	1.082 g/cm³
Appearance:	Liquid
MDL:	MFCD06245419
LogP:	1.13490

Publication Number	Title	Priority Date
WO-2021122415-A1	Furoindazole derivatives	20191219
KR-102296678-B1	Polymer dispersion composition of polyurethane type and method of manufacturing the same	20191210
KR-20210073177-A	Polymer dispersion composition of polyurethane type and method of manufacturing the same	20191210
CN-112876355-A	Method for preparing carboxylic ester compound by breaking carbon-carbon bond through oxidation of secondary alcohol compound	20191129
CN-112409114-A	Method for synthesizing secondary alcohol	20190820

PMID	Publication Date	Title	Journal
21670533	20110101	Purification and characterization of an NADH-dependent alcohol dehydrogenase from Candida maris for the synthesis of optically active 1-(pyridyl)ethanol derivatives	Bioscience, biotechnology, and biochemistry
18971317	20090201	Drug interaction potential of 2-((3,4-dichlorophenethyl)(propyl)amino)-1-(pyridin-3-yl)ethanol (LK-935), the novel nonstatin-type cholesterol-lowering agent	Drug metabolism and disposition: the biological fate of chemicals
17964172	20080101	Novel cholesterol biosynthesis inhibitors targeting human lanosterol 14alpha-demethylase (CYP51)	Bioorganic & medicinal chemistry
12784622	20030401	Microbial enantioselective reduction of acetylpyridine derivatives	Bioscience, biotechnology, and biochemistry

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GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	85
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	123.068413911
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	123.068413911
Rotatable Bond Count:	1
Topological Polar Surface Area:	33.1 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2