1-(2-Furylmethyl)piperidin-4-one - CAS 41661-55-6

Catalog:	BB024927
Product Name:	1-(2-Furylmethyl)piperidin-4-one
CAS:	41661-55-6
Synonyms:	1-(furan-2-ylmethyl)piperidin-4-one

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Computed Properties

IUPAC Name:	1-(furan-2-ylmethyl)piperidin-4-one
Description:	1-(2-Furylmethyl)piperidin-4-one (CAS# 41661-55-6) is a useful research chemical.
Molecular Weight:	179.22
Molecular Formula:	C10H13NO2
Canonical SMILES:	C1CN(CCC1=O)CC2=CC=CO2
InChI:	InChI=1S/C10H13NO2/c12-9-3-5-11(6-4-9)8-10-2-1-7-13-10/h1-2,7H,3-6,8H2
InChI Key:	HPGJGAKKRDVUJA-UHFFFAOYSA-N
Boiling Point:	281.5 °C at 760 mmHg
Density:	1.155 g/cm³
LogP:	1.38240

Publication Number	Title	Priority Date
US-2016091807-A1	Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus and phthalocyanine crystal	20130528
WO-2014192840-A1	Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus and phthalocyanine crystal	20130528
CN-102898523-A	N-substituted-tetrahydropyridylindole-monoclonal antibody CD14 conjugates, and preparation method and application thereof	20121019
CN-102898523-B	N-substituted-tetrahydropyridylindole-monoclonal antibody CD14 conjugates, and preparation method and application thereof	20121019
US-4053615-A	Phthalimidopiperidines and anti-convulsant compositions thereof	19721021

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	183
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	179.094628657
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	179.094628657
Rotatable Bond Count:	2
Topological Polar Surface Area:	33.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3