2-Acetylpyridine

HCID 14286CAS 1122-62-9

Grundinformationen

Standard-SMILES
CC(=O)c1ccccn1
InChIKey
AJKVQEKCUACUMD-UHFFFAOYSA-N
Summenformel
C7H7NO
Durchschnittliche Molmasse
121,14 g/mol
Monoisotopische Masse
121,05276385

Namen und Bezeichner

Bevorzugter Name
2-Acetylpyridine
IUPAC
1-pyridin-2-ylethanone
Englischer Name
Methylpyridylketone
Summenformel
C7H7NO
Molmasse
0

Namen und Synonyme

2-ACETYLPYRIDINE1122-62-91-pyridin-2-ylethanoneMethyl 2-pyridyl ketone1-(Pyridin-2-Yl)Ethan-1-OneKetone, methyl 2-pyridyl2-AcetopyridineEthanone, 1-(2-pyridinyl)-FEMA No. 3251629O10UI3LNSC-15043RefChem:85007
Weitere Namen anzeigen
214-355-61-(pyridin-2-yl)ethanoneAcetylpyridine1-(2-Pyridinyl)ethanone2-Pyridyl methyl ketone1-Pyridin-2-yl-ethanoneMFCD00006303Acetyl pyridine

Datenbank-Bezeichner

CAS
1122-62-9、30440-88-1
PubChem CID
14286
DTXSID
DTXSID7024409
ChEMBL
CHEMBL11945
ChEBI
CHEBI:193619
UNII
629O10UI3L
EC Number
214-355-6
Nikkaji
J71.242F

Eigenschaften

Berechnete Struktureigenschaften

XLogP
0,9
Polarare Oberfläche (TPSA)
30 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
1
Schwere Atome
9

Experimentelle und physikochemische Eigenschaften

LogP0.85
Density1.077-1.084
Solubility · 2 Einträge

Soluble in ether and acids

Soluble (in ethanol)

Boiling Point · 2 Einträge

189.00 to 193.00 °C. @ 760.00 mm Hg

189-193 °C

Vapor Pressure0.37 [mmHg]
Refractive Index1.518-1.524

Physikochemische Eigenschaften

Siedepunkt
225.84 °C · 225.84°C (rough estimate)
Dichte
1.1344 · 1.1344 (rough estimate)
Brechungsindex
1.5323 · 1.5323 (estimate)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 73.1% (320 of 438) of all reports.

Warning

H315 (26.9%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (26.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (23.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 438 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 320 of 438 reports by companies.;There are 9 notifications provided by 118 of 438 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: Ethanone, 1-(2-pyridinyl)-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

Methyl 2-pyridyl ketone: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummarySafe when used as a flavoring agent in food; [JECFA] A skin and strong eye irritant; [Alfa Aesar MSDS]
Hazard Classes and CategoriesSkin Irrit. 2 (26.9%);Eye Irrit. 2A (26.3%);STOT SE 3 (23.7%)

Regulatorische Informationen

Regulatory Information · 3 Einträge

Chemical: Ethanone, 1-(2-pyridinyl)-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

Methyl 2-pyridyl ketone: Does not have an individual approval but may be used under an appropriate group standard

Chemie und Industrie

Pharmakologische Informationen

Cellular LocationsCytoplasm;Extracellular

Verwendung und Herstellung

UsesUsed as a flavoring agent; [FDA]
Use Classification · 3 Einträge

Fragrance Ingredients

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

General Manufacturing InformationEthanone, 1-(2-pyridinyl)-: ACTIVE

Anbieter50 Anbieter

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衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
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