N-Acetylhomopiperazine - CAS 61903-11-5

Catalog:	BB031314
Product Name:	N-Acetylhomopiperazine
CAS:	61903-11-5
Synonyms:	1-(1,4-diazepan-1-yl)ethanone

Technical Data

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Computed Properties

IUPAC Name:	1-(1,4-diazepan-1-yl)ethanone
Description:	N-Acetylhomopiperazine (CAS# 61903-11-5) is a useful research chemical.
Molecular Weight:	142.20
Molecular Formula:	C7H14N2O
Canonical SMILES:	CC(=O)N1CCCNCC1
InChI:	InChI=1S/C7H14N2O/c1-7(10)9-5-2-3-8-4-6-9/h8H,2-6H2,1H3
InChI Key:	TWJPZMYNUBAUGA-UHFFFAOYSA-N
Boiling Point:	274.5 °C at 760 mmHg
Purity:	98 %
Density:	1.077 g/mL at 20 °C (lit.)
MDL:	MFCD00674492
LogP:	0.09490

Publication Number	Title	Priority Date
KR-20210095806-A	Etching fluid, replenishing fluid, and method for forming copper wiring	20200124
CN-112047935-A	Autophagy targeting protein degradation technology and application thereof	20190605
US-2020385336-A1	Cytotoxic compounds, pharmaceutical compositions thereof, and methods of treating cancer	20190604
US-10988439-B2	Cytotoxic compounds, pharmaceutical compositions thereof, and methods of treating cancer	20190604
JP-2020193282-A	Antifouling paint composition	20190529

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GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	125
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	142.110613074
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	142.110613074
Rotatable Bond Count:	0
Topological Polar Surface Area:	32.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.6