1,2-Epoxycyclododecan

13-Oxabicyclo[10.1.0]tridecane

HCID 9248

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Grundinformationen

CAS: 286-99-7
Standard-SMILES: C1CCCCCC2OC2CCCC1
InChIKey: VLJLXEKIAALSJE-UHFFFAOYSA-N
Summenformel: C12H22O
Durchschnittliche Molmasse: 182,3 g/mol
Monoisotopische Masse: 182,16706532

Namen und Bezeichner

Bevorzugter Name: 13-Oxabicyclo[10.1.0]tridecane
IUPAC: 13-oxabicyclo[10.1.0]tridecane
Lokaler Name: 1,2-Epoxycyclododecan
Englischer Name: 1,2-Epoxycyclododecane
Summenformel: C12H22O
Molmasse: 182.3

Namen und Synonyme

13-Oxabicyclo[10.1.0]tridecane1,2-Epoxycyclododecane286-99-7CYCLODODECANE EPOXIDECCRIS 375413-Oxabicyclo(10.1.0)tridecaneEINECS 206-012-4NSC 521077AI3-26439DTXSID00883355RefChem:7850613-Oxabicyclo10.1.0tridecane

Weitere Namen anzeigen

CyclododecaneEoxideCYCLODODECANE OXIDE13-Oxabicyclo[10.1.01,2-EPOXYCYCLODODECANE 95+%Cyclododecane epoxide isomers

DTXCID301022892206-012-4VLJLXEKIAALSJE-UHFFFAOYSA-NCyclododecene oxideEpoxycyclododecaneCyclododecene epoxideCyclododecane, 1,2-epoxy-MFCD00005116

Datenbank-Bezeichner

CAS: 286-99-7
PubChem CID: 9248
DTXSID: DTXSID00883355
EC Number: 206-012-4
Nikkaji: J113.652F

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 4,4
Polarare Oberfläche (TPSA): 12,5 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 0
Schwere Atome: 13
Formalladung: 0
Komplexität: 128

Physikochemische Eigenschaften

Schmelzpunkt: -7 °C · -7 °C
Siedepunkt: 274 · 274-276 °C(lit.)
Dichte: 0.947 g/mL · 0.947 g/mL at 20 °C(lit.)
Brechungsindex: 20 · n20/D 1.481
Flammpunkt: 230 °F · >230 °F
storage temp.: 2 · Sealed in dry,2-8°C
Aggregatzustand: clear liquid
Farbe: Colorless to Light yellow
BRN: 106689 · 106689
Kosmetik-Inhaltsstoffe Funktionen: PERFUMING
InChI: 1S/C12H22O/c1-2-4-6-8-10-12-11(13-12)9-7-5-3-1/h11-12H,1-10H2
InChIKey: VLJLXEKIAALSJE-UHFFFAOYSA-N
SMILES: C1CCCCCC2OC2CCCC1
LogP: 4.7 · 4.700
CAS Datenbank: 286 · 286-99-7(CAS DataBase Reference)
EPA chemische Informationen: Cyclododecene oxide (286-99-7)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 83% (186 of 224) of all reports.

Warning

H315 (17%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P280, P302+P352, P321, P332+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 224 reports by companies from 2 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 186 of 224 reports by companies.；There is 1 notification provided by 38 of 224 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.