Grundinformationen
- Standard-SMILES
C#CC1(O)CCOCC1- InChIKey
SWJWVPMUAUALKX-UHFFFAOYSA-N- Summenformel
- C7H10O2
- Durchschnittliche Molmasse
- 126,15 g/mol
Namen und Bezeichner
- Bevorzugter Name
- 4-Ethynyloxan-4-ol
- IUPAC
- 4-ethynyloxan-4-ol
- Englischer Name
- 2H-Pyran-4-ol, 4-ethynyltetrahydro- (9CI)
- Summenformel
- C7H10O2
- Molmasse
- 126.15
Namen und Synonyme
57385-16-74-ETHYNYLOXAN-4-OLRefChem:522959855-701-14-ETHYNYLTETRAHYDROPYRAN-4-OL4-ethynyltetrahydro-2H-pyran-4-ol2H-Pyran-4-ol, 4-ethynyltetrahydro- (9CI)MFCD18814953SCHEMBL2366654-ethynyl-tetrahydropyran-4-ol4-ethynyl-tetrahydro-pyran-4-olSWJWVPMUAUALKX-UHFFFAOYSA-N
Weitere Namen anzeigen
2H-Pyran-4-ol, 4-ethynyltetrahydro-AKOS014246344PB25698AS-51351DA-04742SY042348CS-00508684-Ethynyltetrahydropyran-4-ol - [E11763]
Datenbank-Bezeichner
- CAS
57385-16-7- PubChem CID
- 15550485
- EC Number
- 855-701-1
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -0,1
- Polarare Oberfläche (TPSA)
- 29,5 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 136
Physikochemische Eigenschaften
- Schmelzpunkt
- 62 · 62-63 °C
- Siedepunkt
- 214.4 · 214.4±40.0 °C(Predicted)
- Dichte
- 1.09 · 1.09±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, stored under nitrogen
- pka
- 12.65 · 12.65±0.20(Predicted)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- hs_code
- 2932990090
Chemie und Industrie
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