2-Isopropylpiperazine - CAS 84468-53-1

Catalog:	BB037209
Product Name:	2-Isopropylpiperazine
CAS:	84468-53-1
Synonyms:	2-propan-2-ylpiperazine; 2-propan-2-ylpiperazine

Technical Data

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Computed Properties

IUPAC Name:	2-propan-2-ylpiperazine
Description:	2-Isopropylpiperazine (CAS# 84468-53-1) is a useful research chemical.
Molecular Weight:	128.22
Molecular Formula:	C7H16N2
Canonical SMILES:	CC(C)C1CNCCN1
InChI:	InChI=1S/C7H16N2/c1-6(2)7-5-8-3-4-9-7/h6-9H,3-5H2,1-2H3
InChI Key:	HBCSNWKQNPKIHK-UHFFFAOYSA-N
Boiling Point:	184.1 °C at 760 mmHg
Density:	0.851 g/cm³
MDL:	MFCD07373042
LogP:	2.46540

Publication Number	Title	Priority Date
WO-2021127217-A1	Combination anti-cancer therapies with inducers of iron-dependent cellular disassembly	20191217
WO-2021085600-A1	Composite semipermeable membrane and manufacturing method therefor	20191031
US-2021115570-A1	Method of inhibiting metal corrosion with a piperazine-based polyurea	20191016
WO-2021027304-A1	Analgesic compound, preparation method therefor, and pharmaceutical use thereof	20190814
WO-2021016102-A1	Inhibitors of tyrosine kinase	20190719

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GHS Hazard Statement:	H319 (97.44%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement:	P264, P273, P280, P305+P351+P338, P337+P313, P391, and P501
Signal Word:	Warning

Complexity:	81
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	128.131348519
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	128.131348519
Rotatable Bond Count:	1
Topological Polar Surface Area:	24.1 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5