1-(2-Hydroxyethyl)-4-methylpiperazine - CAS 5464-12-0

Catalog:	BB028745
Product Name:	1-(2-Hydroxyethyl)-4-methylpiperazine
CAS:	5464-12-0
Synonyms:	2-(4-methyl-1-piperazinyl)ethanol; 2-(4-methylpiperazin-1-yl)ethanol

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Computed Properties

IUPAC Name:	2-(4-methylpiperazin-1-yl)ethanol
Description:	1-(2-Hydroxyethyl)-4-methylpiperazine (CAS# 5464-12-0) is a useful research chemical.
Molecular Weight:	144.21
Molecular Formula:	C7H16N2O
Canonical SMILES:	CN1CCN(CC1)CCO
InChI:	InChI=1S/C7H16N2O/c1-8-2-4-9(5-3-8)6-7-10/h10H,2-7H2,1H3
InChI Key:	QHTUMQYGZQYEOZ-UHFFFAOYSA-N
Boiling Point:	234.9 °C at 760 mmHg
Density:	1.003 g/cm³
Solubility:	Other solvents(Soluble) : Methanol
Appearance:	Low mp solid
MDL:	MFCD03840691
LogP:	-0.89810

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GHS Hazard Statement:	H302 (14.29%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	89.6
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	144.126263138
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	144.126263138
Rotatable Bond Count:	2
Topological Polar Surface Area:	26.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.6