2,2-Dimethylpiperazine - CAS 84477-72-5

Catalog:	BB037213
Product Name:	2,2-Dimethylpiperazine
CAS:	84477-72-5
Synonyms:	2,2-dimethylpiperazine; 2,2-dimethylpiperazine

Technical Data

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Computed Properties

IUPAC Name:	2,2-dimethylpiperazine
Description:	2,2-Dimethylpiperazine (CAS# 84477-72-5) is a chemical reagent used in the preparation of non-covalent NAAA inhibitors used as a protective agent for the development of multiple sclerosis.
Molecular Weight:	114.19
Molecular Formula:	C6H14N2
Canonical SMILES:	CC1(CNCCN1)C
InChI:	InChI=1S/C6H14N2/c1-6(2)5-7-3-4-8-6/h7-8H,3-5H2,1-2H3
InChI Key:	PIPWSBOFSUJCCO-UHFFFAOYSA-N
Boiling Point:	155.174 °C at 760 mmHg
Density:	0.834 g/cm³
MDL:	MFCD06798288
LogP:	0.61540

Publication Number	Title	Priority Date
WO-2021121367-A1	Kras mutant protein inhibitors	20191219
WO-2021102300-A1	Piperazine compounds for inhibiting cps1	20191122
WO-2021085600-A1	Composite semipermeable membrane and manufacturing method therefor	20191031
WO-2021072212-A1	Proteasome inhibitors	20191011
WO-2021067035-A1	Polyol resin blend for use in producing stable polyol components	20191002

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Complexity:	78.6
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	114.115698455
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	114.115698455
Rotatable Bond Count:	0
Topological Polar Surface Area:	24.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.2