4-Oxopentyl Acetate - CAS 5185-97-7

Catalog:	BB027629
Product Name:	4-Oxopentyl Acetate
CAS:	5185-97-7
Synonyms:	acetic acid 4-oxopentyl ester; 4-oxopentyl acetate

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	4-oxopentyl acetate
Description:	4-Oxopentyl Acetate (CAS# 5185-97-7 ) is a useful research chemical.
Molecular Weight:	144.17
Molecular Formula:	C7H12O3
Canonical SMILES:	CC(=O)CCCOC(=O)C
InChI:	InChI=1S/C7H12O3/c1-6(8)4-3-5-10-7(2)9/h3-5H2,1-2H3
InChI Key:	QYAHGDMPUORRQD-UHFFFAOYSA-N
Boiling Point:	213.9 °C at 760 mmHg
Density:	0.996 g/cm³
MDL:	MFCD00466609
LogP:	0.91870

Publication Number	Title	Priority Date
WO-2021104483-A1	Sulfonic acid quaternary ammonium salt compound, preparation method and application thereof	20191129
WO-2021041825-A1	Sphingolipid-based selenium compounds, methods for their preparation, and pharmaceutical uses thereof, including as antitumor agents	20190830
US-10836705-B1	Process for the production of bretylium tosylate	20190814
WO-2020131895-A1	Substituted heterocycle fused gamma-carbolines synthesis	20181217
WO-2020131911-A1	Substituted heterocycle fused gamma-carbolines synthesis	20181217

PMID	Publication Date	Title	Journal
21341539	20100801	Antinociceptive and acute toxicity evaluation of Vernonia condensata Baker leaves extracted with different solvents and their mixtures	Indian journal of experimental biology
18639882	20080822	Simultaneous determination of pharmaceuticals, endocrine disrupting compounds and hormone in soils by gas chromatography-mass spectrometry	Journal of chromatography. A
17386740	20070314	Multiwalled carbon nanotubes as a solid-phase extraction adsorbent for the determination of three barbiturates in pork by ion trap gas chromatography-tandem mass spectrometry (GC/MS/MS) following microwave assisted derivatization	Analytica chimica acta
11717001	20011001	Metabolism of dehydroepiandrosterone by rat hippocampal cells in culture: possible role of aromatization and 7-hydroxylation in neuroprotection	The Journal of steroid biochemistry and molecular biology

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Related Functional Groups

Carbonyl Compounds

[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[957292-12-5]
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[1016519-61-1]
2-(Methyl-2-pyridylamino)acetic Acid

Complexity:	129
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	144.078644241
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	144.078644241
Rotatable Bond Count:	5
Topological Polar Surface Area:	43.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1