1-Ethyl-4-piperidone - CAS 3612-18-8

Catalog:	BB022868
Product Name:	1-Ethyl-4-piperidone
CAS:	3612-18-8
Synonyms:	1-ethylpiperidin-4-one

Technical Data

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Computed Properties

IUPAC Name:	1-ethylpiperidin-4-one
Description:	1-Ethyl-4-piperidone (CAS# 3612-18-8) is a useful research chemical.
Molecular Weight:	127.18
Molecular Formula:	C7H13NO
Canonical SMILES:	CCN1CCC(=O)CC1
InChI:	InChI=1S/C7H13NO/c1-2-8-5-3-7(9)4-6-8/h2-6H2,1H3
InChI Key:	BDVKAMAALQXGLM-UHFFFAOYSA-N
Boiling Point:	46-48 °C (1 mmHg)
Melting Point:	30-32 °C
Purity:	98 %
Density:	0.939 g/cm³
Appearance:	Clear yellow to brown viscous liquid
Storage:	2-8 °C
MDL:	MFCD00013356
LogP:	0.60910

Publication Number	Title	Priority Date
JP-2021046434-A	A new method for producing a perfluoroalkylating agent using monohydroperfluoroalkane as a starting material, and a method for producing an aromatic perfluoroalkyl compound using them.	20201207
JP-2021054833-A	A new method for producing a perfluoroalkylating agent using monohydroperfluoroalkane as a starting material, and a method for producing an aromatic perfluoroalkyl compound using them.	20201207
JP-2021054834-A	A new method for producing a perfluoroalkylating agent using monohydroperfluoroalkane as a starting material, and a method for producing an aromatic perfluoroalkyl compound using them.	20201207
CN-112175217-A	Anion exchange membrane containing arylene piperidine and diketone monomer copolymer and preparation method and application thereof	20200901
CN-111533739-A	Process for the preparation of 3-alkyl-3, 9-diazaspiro [5,5] undecanes	20200508

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Related Functional Groups

Piperidones

[1454-53-1]
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[518990-24-4]
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[3731-16-6]
Ethyl 2-oxo-3-piperidinecarboxylate
[32161-06-1]
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[1215071-17-2]
N-Boc-3,3-difluoropiperidin-4-one
[396731-40-1]
N-Boc-3,5-dioxopiperidine

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GHS Hazard Statement:	H227 (50%): Combustible liquid [Warning Flammable liquids]
Precautionary Statement:	P210, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501
Signal Word:	Warning

Complexity:	102
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	127.099714038
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	127.099714038
Rotatable Bond Count:	1
Topological Polar Surface Area:	20.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1