Oxonane-2,9-dione

HCID 9543534CAS 10521-06-9

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Grundinformationen

Standard-SMILES: O=C1CCCCCCC(=O)O1
InChIKey: RMIBXGXWMDCYEK-UHFFFAOYSA-N
Summenformel: C8H12O3
Durchschnittliche Molmasse: 156,18 g/mol
Monoisotopische Masse: 156,07864424

Namen und Bezeichner

Bevorzugter Name: Oxonane-2,9-dione
IUPAC: oxonane-2,9-dione
Englischer Name: Suberic anhydride
Summenformel: C8H12O3
Molmasse: 156.18

Namen und Synonyme

OXONANE-2,9-DIONERefChem:857802819-551-0Suberic anhydride10521-06-9KorksaureanhydridSCHEMBL449061DTXSID80429492RMIBXGXWMDCYEK-UHFFFAOYSA-NMFCD18253479AKOS037652171FS165392

Weitere Namen anzeigen

1860902,9-OxonanedioneOxanane-2,9-dioneHexanedicarboxylic anhydride

SY349681DB-009260CS-0376339G21924EN300-1693604F760678

Datenbank-Bezeichner

CAS: 10521-06-9
PubChem CID: 9543534
DTXSID: DTXSID80429492
EC Number: 819-551-0
Nikkaji: J801.598H

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,3
Polarare Oberfläche (TPSA): 43,4 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 0
Schwere Atome: 11
Formalladung: 0
Komplexität: 145

Physikochemische Eigenschaften

Schmelzpunkt: 65 · 65-66 °C
Siedepunkt: 291 · 291.0±9.0 °C(Predicted)
Dichte: 1.086 · 1.086±0.06 g/cm3(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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.