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HCID 7172021Erstellt: 26. Oktober 2026

Methyl 2-methoxy-4-methylbenzoate

Methyl o-methoxy-p-toluate · Methyl 2-methoxy-4-methylbenzoate · Methyl 4-Methyl-2-Methoxybenzoate · 2-Methoxy-4-Methylbenzoic acid Methyl ester · Benzoic acid, 2-Methoxy-4-Methyl-, Methyl ester · 2-methoxy-4-methyl-Benzoic acid methyl ester (9CI ACI) · Benzoic acid, 2-methoxy-4-methyl-, methyl ester (9CI, ACI)

https://huagongshe.com/de/chemical/7172021

Molekülstruktur von Methyl 2-methoxy-4-methylbenzoate

Identifikatoren & physikalische Daten

CAS No.81245-24-1
SummenformelC10H12O3
Durchschnittliche Molmasse180,2 g/mol
Monoisotopische Masse180,07864424 g/mol
SMILESCOC(=O)c1ccc(C)cc1OC
InChIKeyLHNVKRSDQCCHEK-UHFFFAOYSA-N
PubChem CID7172021
EC No.963-956-6
DTXSIDDTXSID401001869

Chemische & physikalische Eigenschaften

XLogP2,4
Polarare Oberfläche (TPSA)35,5
H-Brücken-Donoren0
H-Brücken-Akzeptoren3
Frei drehbare Bindungen3
Schwere Atome13
Formalladung0
Komplexität179
Schmelzpunkt29℃
Siedepunkt263-265℃
Dichte1.075±0.06 g/cm3(Predicted)
Brechungsindex1.5230 (589.3 nm 18℃)
LagerbedingungenSealed in dry,Room Temperature
InChIInChI=1S/C10H12O3/c1-7-4-5-8(10(11)13-3)9(6-7)12-2/h4-6H,1-3H3
InChIKeyLHNVKRSDQCCHEK-UHFFFAOYSA-N
SMILESC(OC)(=O)C1=CC=C(C)C=C1OC

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)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
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