4-(2-Hydroxyethyl)thiazole - CAS 180207-28-7

Catalog:	BB013653
Product Name:	4-(2-Hydroxyethyl)thiazole
CAS:	180207-28-7
Synonyms:	2-(4-thiazolyl)ethanol; 2-(1,3-thiazol-4-yl)ethanol

Technical Data

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Computed Properties

IUPAC Name:	2-(1,3-thiazol-4-yl)ethanol
Description:	4-(2-Hydroxyethyl)thiazole (CAS# 180207-28-7) is a useful research chemical.
Molecular Weight:	129.18
Molecular Formula:	C5H7NOS
Canonical SMILES:	C1=C(N=CS1)CCO
InChI:	InChI=1S/C5H7NOS/c7-2-1-5-3-8-4-6-5/h3-4,7H,1-2H2
InChI Key:	ZOGHXTOEFVTKBW-UHFFFAOYSA-N
LogP:	0.67790

Publication Number	Title	Priority Date
WO-2021102114-A1	Substituted heterocyclics with therapeutic activity in hiv	20191119
AU-2018316588-A1	Pyruvate kinase modulators and use thereof	20170815
CA-3072455-A1	Pyruvate kinase modulators and use thereof	20170815
CN-111032046-A	Pyruvate kinase modulators and uses thereof	20170815
EP-3668512-A1	Pyruvate kinase modulators and use thereof	20170815

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GHS Hazard Statement:	H302 (100%): 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:	69.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	129.02483502
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	129.02483502
Rotatable Bond Count:	2
Topological Polar Surface Area:	61.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6