Morpholin-3-on

3-Morpholinone

HCID 66953CAS 109-11-5

Grundinformationen

Standard-SMILES
O=C1COCCN1
InChIKey
VSEAAEQOQBMPQF-UHFFFAOYSA-N
Summenformel
C4H7NO2
Durchschnittliche Molmasse
101,1 g/mol
Monoisotopische Masse
101,04767847

Namen und Bezeichner

Bevorzugter Name
3-Morpholinone
IUPAC
morpholin-3-one
Lokaler Name
Morpholin-3-on
Englischer Name
morpholin-3-one
Summenformel
C4H7NO2
Molmasse
101.1

Namen und Synonyme

Morpholin-3-one3-MorpholinoneEINECS 203-647-9DTXSID3074444NSC 11688RefChem:94983DTXCID1033115203-647-9109-11-53-KetomorpholineMFCD00631009morpholinone
Weitere Namen anzeigen
morpholine-3-onein-3-on3-morpholoneJACS-109-11-5Morpholin-3-on3-morpholineone
V6P29M33NGNSC-116883-oxomorpholine3-oxo-morpholineNSC11688UNII-V6P29M33NGSCHEMBL28804SCHEMBL28805

Datenbank-Bezeichner

CAS
109-11-5
PubChem CID
66953
DTXSID
DTXSID3074444
UNII
V6P29M33NG
EC Number
203-647-9
Nikkaji
J193.575E

Eigenschaften

Berechnete Struktureigenschaften

XLogP
-0,8
Polarare Oberfläche (TPSA)
38,3 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
0
Schwere Atome
7

Physikochemische Eigenschaften

Schmelzpunkt
103 to · 103.0 to 107.0 °C
Siedepunkt
142 °C/7mmHg · 142°C/7mmHg(lit.)
Dichte
1.122 · 1.122±0.06 g/cm3(Predicted)
storage temp.
Inert atmosphere,Room Temperature
Löslichkeit
soluble in Methanol
Aggregatzustand
powder to crystal

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 66.2% (104 of 157) of all reports.

Danger

H302 (33.1%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (26.8%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (26.1%): May cause an allergic skin reaction [Warning Sensitization, Skin];H318 (31.8%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H335 (26.1%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 157 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 104 of 157 reports by companies.;There are 8 notifications provided by 53 of 157 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

Hazard Classes and CategoriesAcute Tox. 4 (33.1%);Skin Irrit. 2 (26.8%);Skin Sens. 1 (26.1%);Eye Dam. 1 (31.8%);STOT SE 3 (26.1%)

Sicherheitsdaten

hs_code
29349990
safety_code
24/25

Chemie und Industrie

Anwendungen · 1 Eintrag

Beschreibung3-ketomorpholine is also known as morpholin-3-one. It is useful pharmacological intermediate. Recent studies have shown that some morpholin-3-one derivatives could effectively cause cell cycle arrest at G1 phase, increase the levels of P53 and Fas, and induce A549 cell apoptosis in lung cancer. This indicates it might be a useful tool for elucidating the molecular mechanism of lung cancer cell apoptosis and might also be potential anti-cancer drugs. Some of its derivatives have been proven to be useful for the prevention and treatment of arteriosclerosis and hypertriglyceridemia.

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