Piperazine-2-methanol - CAS 28795-50-8

Catalog:	BB019956
Product Name:	Piperazine-2-methanol
CAS:	28795-50-8
Synonyms:	2-piperazinylmethanol; piperazin-2-ylmethanol

Technical Data

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Computed Properties

IUPAC Name:	piperazin-2-ylmethanol
Description:	Piperazine-2-methanol (CAS# 28795-50-8) is a useful compound in the chemical process of acidic gas removal.
Molecular Weight:	116.16
Molecular Formula:	C5H12N2O
Canonical SMILES:	C1CNC(CN1)CO
InChI:	InChI=1S/C5H12N2O/c8-4-5-3-6-1-2-7-5/h5-8H,1-4H2
InChI Key:	SIRSTRHGFGFVME-UHFFFAOYSA-N
Boiling Point:	234.479 °C at 760 mmHg
Density:	0.992 g/cm³
LogP:	-0.80230

Publication Number	Title	Priority Date
WO-2015150555-A1	Macrocylic pyrimidine derivatives	20140403
WO-2015107545-A1	Water soluble salts of dasatinib hydrate	20131218
WO-2015058129-A1	Compositions useful for treating disorders related to kit	20131017
WO-2014164749-A1	Novel compounds and compositions for inhibition of fasn	20130313
WO-2014164767-A1	Novel compounds and compositions for inhibition of fasn	20130313

PMID	Publication Date	Title	Journal
15158798	20040615	Chiral, nonracemic (piperazin-2-yl)methanol derivatives with sigma-receptor affinity	Bioorganic & medicinal chemistry

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Complexity:	67.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	116.094963011
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	116.094963011
Rotatable Bond Count:	1
Topological Polar Surface Area:	44.3
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	-1.5