Grundinformationen
- Standard-SMILES
c1cc(-c2ccc(OCC3CO3)cc2)ccc1OCC1CO1- InChIKey
OZRVXYJWUUMVOW-UHFFFAOYSA-N- Summenformel
- C18H18O4
- Durchschnittliche Molmasse
- 298,3 g/mol
- Monoisotopische Masse
- 298,12050905
Namen und Bezeichner
- Bevorzugter Name
- 4,4'-Bis(2,3-epoxypropoxy)biphenyl
- IUPAC
- 2-[[4-[4-(oxiran-2-ylmethoxy)phenyl]phenoxy]methyl]oxirane
- Lokaler Name
- 4,4'-Bis(2,3-epoxypropoxy)biphenyl
- Englischer Name
- 4,4'-bis(2,3-epoxypropoxy)biphenyl
- Summenformel
- C18H18O4
- Molmasse
- 298.33
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
2461-46-3、90837-23-3- PubChem CID
- 102824
- DTXSID
DTXSID90947511- EC Number
- 219-556-2
- Nikkaji
- J216.103F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,9
- Polarare Oberfläche (TPSA)
- 43,5 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 22
- Formalladung
- 0
- Komplexität
- 311
Physikochemische Eigenschaften
- Schmelzpunkt
- 156 °C · 156 °C
- Siedepunkt
- 473.6 · 473.6±30.0 °C(Predicted)
- Dichte
- 1.226 · 1.226±0.06 g/cm3(Predicted)
- InChI
- InChI=1S/C18H18O4/c1-5-15(19-9-17-11-21-17)6-2-13(1)14-3-7-16(8-4-14)20-10-18-12-22-18/h1-8,17-18H,9-12H2
- InChIKey
- OZRVXYJWUUMVOW-UHFFFAOYSA-N
- SMILES
- C1(C2=CC=C(OCC3CO3)C=C2)=CC=C(OCC2CO2)C=C1
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H341 (100%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]
P203, P261, P264, P264+P265, P272, P280, P302+P352, P305+P351+P338, P318, P321, P332+P317, P333+P317, P337+P317, P362+P364, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 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.
Gefahrenhinweise
Regulatorische Informationen
Sicherheitsdaten
- tsca
- TSCA listed
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