Grundinformationen
- Standard-SMILES
COC(=O)C1=C(O)COC1=O- InChIKey
GIWLDPURHIORDX-UHFFFAOYSA-N- Summenformel
- C6H6O5
- Durchschnittliche Molmasse
- 158,11 g/mol
- Monoisotopische Masse
- 158,02152329
Namen und Bezeichner
- Bevorzugter Name
- Methyl 4-hydroxy-2-oxo-2,5-dihydrofuran-3-carboxylate
- IUPAC
- methyl 3-hydroxy-5-oxo-2H-furan-4-carboxylate
Namen und Synonyme
methyl 4-hydroxy-2-oxo-2,5-dihydrofuran-3-carboxylate78376-09-7RefChem:816457620-312-64-hydroxy-2-oxo-2,5-dihydro-furan-3-carboxylic acid methyl esterSCHEMBL230467GIWLDPURHIORDX-UHFFFAOYSA-GIWLDPURHIORDX-UHFFFAOYSA-NAKOS024341038NS000409654-(methoxycarbonyl)-5-oxo-2,5-dihydrofuran-3-olmethyl4-hydroxy-2-oxo-2,5-dihydrofuran-3-carboxylate
Weitere Namen anzeigen
methyl 4-hydroxy-2-oxo-2,5-dihydro-3-furancarboxylateInChI=1/C6H6O5/c1-10-5(8)4-3(7)2-11-6(4)9/h7H,2H2,1H3
Datenbank-Bezeichner
- CAS
78376-09-7- PubChem CID
- 54677706
- EC Number
- 620-312-6
- Nikkaji
- J1.855.736C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,2
- Polarare Oberfläche (TPSA)
- 72,8 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 239
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.
Warning
H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (50%): 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.；Reported as not meeting GHS hazard criteria per 1 of 2 reports by companies.；There is 1 notification provided by 1 of 2 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.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (50%)；Eye Irrit. 2A (50%)；STOT SE 3 (50%)
Zugehörige Reaktionen
3
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