4-(2-Hydroxyethyl)-4H-1,2,4-triazole - CAS 66760-19-8

Catalog:	BB033097
Product Name:	4-(2-Hydroxyethyl)-4H-1,2,4-triazole
CAS:	66760-19-8
Synonyms:	2-(1,2,4-triazol-4-yl)ethanol; 2-(1,2,4-triazol-4-yl)ethanol

Technical Data

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Patents

Computed Properties

IUPAC Name:	2-(1,2,4-triazol-4-yl)ethanol
Description:	4-(2-Hydroxyethyl)-4H-1,2,4-triazole (CAS# 66760-19-8) is a useful research chemical.
Molecular Weight:	113.12
Molecular Formula:	C4H7N3O
Canonical SMILES:	C1=NN=CN1CCO
InChI:	InChI=1S/C4H7N3O/c8-2-1-7-3-5-6-4-7/h3-4,8H,1-2H2
InChI Key:	YOSYLAYVXLOORB-UHFFFAOYSA-N
Boiling Point:	299.6 °C at 760 mmHg
Density:	1.32 g/cm³
LogP:	-0.72960

Publication Number	Title	Priority Date
WO-2021163254-A1	Heterocyclic pad4 inhibitors	20200212
EP-2881497-A1	Electrosilver plating fluid	20120731
JP-6092219-B2	Electro silver plating solution	20120731
JP-WO2014020981-A1	Electro silver plating solution	20120731
US-2015184307-A1	Silver electroplating solution	20120731

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	62.3
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	113.058911855
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	113.058911855
Rotatable Bond Count:	2
Topological Polar Surface Area:	50.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1.3