1-Acetyl-1-cyclohexene - CAS 932-66-1

Catalog:	BB040825
Product Name:	1-Acetyl-1-cyclohexene
CAS:	932-66-1
Synonyms:	1-(cyclohexen-1-yl)ethanone

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	1-(cyclohexen-1-yl)ethanone
Description:	1-Acetyl-1-cyclohexene (CAS# 932-66-1) is a useful research chemical compound.
Molecular Weight:	124.18
Molecular Formula:	C8H12O
Canonical SMILES:	CC(=O)C1=CCCCC1
InChI:	InChI=1S/C8H12O/c1-7(9)8-5-3-2-4-6-8/h5H,2-4,6H2,1H3
InChI Key:	LTYLUDGDHUEBGX-UHFFFAOYSA-N
Boiling Point:	201-202 °C (lit.)
Melting Point:	73 °C
Purity:	95 %
Density:	0.966 g/mL at 25 °C (lit.)
Appearance:	Liquid
Storage:	Sealed in dry, 2-8 °C
MDL:	MFCD00001547
LogP:	2.07580

Publication Number	Title	Priority Date
CN-112782302-A	Method for measuring acetyl content by derivatization-tandem liquid chromatography mass spectrometry	20201226
CN-111217769-A	Method for synthesizing epoxy compound by catalyzing olefin epoxidation through nano aluminum oxide	20200229
CN-111217710-A	Method for preparing 1, 5-pentanediamine by organic catalysis of L-lysine chemical decarboxylation	20200227
CN-111217710-B	Method for preparing 1, 5-pentanediamine by organic catalysis of L-lysine chemical decarboxylation	20200227
WO-2021091957-A1	Dihydroxylation of olefins using osmate (vi) salts	20191104

PMID	Publication Date	Title	Journal
21249192	20110113	Structure-activity relationship of cinnamaldehyde analogs as inhibitors of AI-2 based quorum sensing and their effect on virulence of Vibrio spp	PloS one
21558759	20110101	Transition metal catalyzed manipulation of non-polar carbon-hydrogen bonds for synthetic purpose	Proceedings of the Japan Academy. Series B, Physical and biological sciences
19588914	20090806	Direct asymmetric catalytic thienylaluminum addition to ketones: a concise approach to the synthesis of (S)-tiemonium iodide	Organic letters
19072696	20090116	Allylic oxidations catalyzed by dirhodium caprolactamate via aqueous tert-butyl hydroperoxide: the role of the tert-butylperoxy radical	The Journal of organic chemistry
18384020	20080101	High-throughput kinetic study of hydrogenation over palladium nanoparticles: combination of reaction and analysis	Chemistry (Weinheim an der Bergstrasse, Germany)

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Complexity:	145
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	124.088815002
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	124.088815002
Rotatable Bond Count:	1
Topological Polar Surface Area:	17.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9