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HCID 14918Erstellt: 26. Oktober 2026

Methyl furan-3-carboxylate

Nsc305748 · 3-furoic ester · METHYL 3-FUROATE · RARECHEM AL BF 0196 · METHYL 3-FURANCARBOXYLATE · thyl furan-3-carboxylate · 3-Methyl furan carboxylate · 3-FUROIC ACID METHYL ESTER

https://huagongshe.com/de/chemical/14918

Molekülstruktur von Methyl furan-3-carboxylate

Identifikatoren & physikalische Daten

CAS No.13129-23-2
SummenformelC6H6O3
Durchschnittliche Molmasse126,11 g/mol
Monoisotopische Masse126,03169405 g/mol
SMILESCOC(=O)c1ccoc1
InChIKeyZKHQSQYLKSSYIP-UHFFFAOYSA-N
PubChem CID14918
EC No.672-679-7
DTXSIDDTXSID00871954

Chemische & physikalische Eigenschaften

XLogP1,3
Polarare Oberfläche (TPSA)39,4
H-Brücken-Donoren0
H-Brücken-Akzeptoren3
Frei drehbare Bindungen2
Schwere Atome9
Formalladung0
Komplexität111
Kovats Retention Index934.4
Schmelzpunkt64-67 °C
Siedepunkt64°C/4mmHg
Dichte1.17
Brechungsindex1.4670 to 1.4700
LagerbedingungenInert atmosphere,Room Temperature
Aggregatzustandclear liquid
FarbeColorless to Light yellow to Light orange
InChIInChI=1S/C6H6O3/c1-8-6(7)5-2-3-9-4-5/h2-4H,1H3
InChIKeyZKHQSQYLKSSYIP-UHFFFAOYSA-N
SMILESO1C=CC(C(OC)=O)=C1
CAS Datenbank13129-23-2(CAS DataBase Reference)
NIST chemische Informationen3-Furancarboxylic acid, methyl ester(13129-23-2)

Sicherheit & Vorschriften

GHS-EinstufungWarningH226 (100%): Flammable liquid and vapor [Warning Flammable liquids]H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (66.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 3 reports by companies from 3 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.
Hazard Classes and CategoriesFlam. Liq. 3 (100%)Skin Irrit. 2 (66.7%)Eye Irrit. 2A (66.7%)STOT SE 3 (66.7%)
UN-TransportnummerUN 3272 3/PG III
Zollcode2932190090
Gefahrenklasse3
VerpackungsgruppeIII