2-Propionylpyridine - CAS 3238-55-9

Catalog:	BB021273
Product Name:	2-Propionylpyridine
CAS:	3238-55-9
Synonyms:	1-(2-pyridinyl)-1-propanone; 1-pyridin-2-ylpropan-1-one

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	1-pyridin-2-ylpropan-1-one
Description:	2-Propionylpyridine (CAS# 3238-55-9) is used in preparation of Oxodiphenyldihydropyrazolecarboxamide derivatives and analogs for use as ACSS2 inhibitors.
Molecular Weight:	135.16
Molecular Formula:	C8H9NO
Canonical SMILES:	CCC(=O)C1=CC=CC=N1
InChI:	InChI=1S/C8H9NO/c1-2-8(10)7-5-3-4-6-9-7/h3-6H,2H2,1H3
InChI Key:	ZHAZHKPVEROFLH-UHFFFAOYSA-N
Boiling Point:	211.7 °C at 760 mmHg
Density:	1.034 g/cm³
MDL:	MFCD00023486
LogP:	1.67430

Publication Number	Title	Priority Date
CN-111349116-A	Bipyridine structure ligand, preparation method thereof, catalytic system based on bipyridine structure and application of catalytic system in ethylene oligomerization	20200427
CN-113073346-A	Electrochemical method for simultaneously preparing o-diol and pyrrole methoxylation products	20200106
WO-2020230136-A1	Acss2 inhibitors and methods of use thereof	20190514
CN-109942476-B	Aromatic heterocyclic compound containing thiosemicarbazone structural unit and preparation method and application thereof	20190419
US-2021171497-A1	Eaat2 activators and methods of using thereof	20180604

PMID	Publication Date	Title	Journal
21628107	20110901	Thirdhand tobacco smoke: emerging evidence and arguments for a multidisciplinary research agenda	Environmental health perspectives
20057948	20091120	Extraction of Teucrium manghuaense and evaluation of the bioactivity of its extract	International journal of molecular sciences
16277417	20051116	Volatile constituents of Semnostachya menglaensis Tsui	Journal of agricultural and food chemistry

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[1018125-51-3]
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid

Complexity:	122
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	135.068413911
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	135.068413911
Rotatable Bond Count:	2
Topological Polar Surface Area:	30
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3