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HCID 32031Erstellt: 26. Oktober 2026

Methyl 2,4-dimethylbenzoate

methyl 2,4-dimethylbenzoate · 2,4-DIMETHYLBENZOIC ACID METHYL ESTER · Benzoic acid, 2,4-dimethyl-, methyl ester · 2,4-dimethyl-Benzoic acid methyl ester (6CI 7CI 8CI 9CI ACI) · Benzoic acid, 2,4-dimethyl-, methyl ester (6CI, 7CI, 8CI, 9CI, ACI)

https://huagongshe.com/de/chemical/32031

Molekülstruktur von Methyl 2,4-dimethylbenzoate

Identifikatoren & physikalische Daten

CAS No.23617-71-2
SummenformelC10H12O2
Durchschnittliche Molmasse164,2 g/mol
Monoisotopische Masse164,08372962 g/mol
SMILESCOC(=O)c1ccc(C)cc1C
InChIKeyQQCLNRPRQRDMCK-UHFFFAOYSA-N
PubChem CID32031
EC No.818-131-4
DTXSIDDTXSID20178290

Chemische & physikalische Eigenschaften

XLogP3,1
Polarare Oberfläche (TPSA)26,3
H-Brücken-Donoren0
H-Brücken-Akzeptoren2
Frei drehbare Bindungen2
Schwere Atome12
Formalladung0
Komplexität165
Schmelzpunkt-2°C
Siedepunkt232.5°C (estimate)
Dichte1.0326 (rough estimate)
Brechungsindex1.5052 (estimate)
LagerbedingungenSealed in dry,Room Temperature
Aggregatzustandsolid
InChI1S/C10H12O2/c1-7-4-5-9(8(2)6-7)10(11)12-3/h4-6H,1-3H3
InChIKeyQQCLNRPRQRDMCK-UHFFFAOYSA-N
SMILESO=C(OC)C1=C(C)C=C(C)C=C1

Sicherheit & Vorschriften

GHS-EinstufungWarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Wassergefährdungsklasse (WGK)WGK 3
Zollcode2916399090
Lagerklasse11 - Combustible Solids
GefahrenklasseAcute Tox. 4 Oral