2-Oxazolidinone

HCID 73949CAS 497-25-6
TeilstruktursucheÄhnliche Strukturen suchen

Grundinformationen

Standard-SMILES
O=C1NCCO1
InChIKey
IZXIZTKNFFYFOF-UHFFFAOYSA-N
Summenformel
C3H5NO2
Durchschnittliche Molmasse
87,08 g/mol
Monoisotopische Masse
87,0320284

Überblick

Oxazolidin-2-one is an oxazolidinone that is 1,3-oxazolidine with an oxo substituent at position 2. It has a role as a metabolite. It is a carbamate ester and an oxazolidinone.

Namen und Bezeichner

Bevorzugter Name
2-Oxazolidinone
IUPAC
1,3-oxazolidin-2-one
Lokaler Name
1,3-Oxazolidin-2-on
Englischer Name
2-Oxazolidone
Summenformel
C3H5NO2
Molmasse
87.08

Namen und Synonyme

2-OxazolidinoneOxazolidin-2-one2-Oxazolidone497-25-61,3-Oxazolidin-2-oneOxazolidoneCHEBI:1237Z4D49W92PPNSC-35382NSC-38240Carbamic acid, (2-hydroxyethyl)-, gamma-lactoneDTXSID2074326
Weitere Namen anzeigen
OxazolidineNSC 353822-Oxazolinone2-OXAZOLIDIONE2-OX2-Oxa
2 oxazolidinone2 OxazolidoneOxazolidin 2 one1,3 Oxazolidin 2 one1,3-oxazolidine-2-oneRefChem:1688681,3 Oxazolidine 2 oneDTXCID4040719

Datenbank-Bezeichner

CAS
497-25-6、51667-26-6
PubChem CID
73949
DTXSID
DTXSID2074326
ChEMBL
CHEMBL1867161
ChEBI
CHEBI:1237
UNII
Z4D49W92PP
EC Number
207-840-9
Nikkaji
J36.850D

Eigenschaften

Berechnete Struktureigenschaften

XLogP
-0,3
Polarare Oberfläche (TPSA)
38,3 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
0
Schwere Atome
6

Experimentelle und physikochemische Eigenschaften

Chemical ClassesNitrogen Compounds -> Other Nitrogen Compounds
SpringerMaterials PropertiesCrystal structure
Solubility>13.1 [ug/mL] (The mean of the results at pH 7.4)
Physical DescriptionBeige crystalline solid; [Sigma-Aldrich MSDS]

Physikochemische Eigenschaften

Schmelzpunkt
83 · 83-87 °C(lit.)
Siedepunkt
220 °C48 · 220 °C48 mm Hg(lit.)
Dichte
1.2736 · 1.2736 (rough estimate)
Brechungsindex
1.494 · 1.4940 (estimate)
Flammpunkt
220 °C/48mm · 220°C/48mm
storage temp.
Sealed in dry,Room Temperature

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

This chemical does not meet GHS hazard criteria for 47.4% (36 of 76) of reports.

Warning

H302 (51.3%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P272, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 76 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Chemical: 2-Oxazolidinone

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Hazards SummaryA strong eye irritant; May cause skin sensitization; Harmful by ingestion; [Sigma-Aldrich MSDS] Search for (497-25-6[EC/RN Number]) AND (allergic OR dermatitis OR sensitizer OR sensitization): no results; [PubMed]
Hazard Classes and CategoriesAcute Tox. 4 (51.3%)

Sicherheitsdaten

wgk
3
tsca
TSCA listed
hs_code
29322980
RTECS-Nr.
RQ2450000
risk_code
22-36-43-40-36/37/38
Toxizität
TDLo orl-mus: 1000 mg/kg:ETA BCPCA62,168,59

Chemie und Industrie

Pharmakologische Informationen

MeSH Pharmacological Classification · 2 Einträge

Substances that prevent infectious agents or organisms from spreading or kill infectious agents in order to prevent the spread of infection.

Compounds which inhibit the synthesis of proteins. They are usually ANTI-BACTERIAL AGENTS or toxins. Mechanism of the action of inhibition includes the interruption of peptide-chain elongation, the blocking the A site of ribosomes, the misreading of the genetic code or the prevention of the attachment of oligosaccharide side chains to glycoproteins.

Verwendung und Herstellung

UsesDerivatives of oxazolidin-2-one. They represent an important class of synthetic antibiotic agents. [ChemIDplus]
General Manufacturing Information2-Oxazolidinone: ACTIVE

Anwendungen

VerwendenAs an oxazole derivative used as an antibiotic, 2-Oxazolidone is also used in the preparation of compounds with antitumor activity and as a metabolite of Furazolidone (F864100).

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

国药集团化学试剂有限公司86-21-63210123 · [email protected]
杭州创引化工科技有限公司0571-87086220 13516718938 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
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]

Ergänzende Hinweise

DefinitionChEBI: An oxazolidinone that is 1,3-oxazolidine with an oxo substituent at position 2.

Zugehörige Reaktionen

513
Reaktionsaufzeichnung erstellen

Verknüpfte Notizen

Wird geladen…