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Basic Information
CAS No.: 6178-44-5
Name: Ethyl 3,4,5-trimethoxybenzoate
Article Data: 46
Molecular Structure:
Molecular Structure of 6178-44-5 (Ethyl 3,4,5-trimethoxybenzoate)
Formula: C12H16 O5
Molecular Weight: 240.256
Synonyms: Ethyl3,4,5-trimethoxybenzoate; NSC 26825
Density: 1.113 g/cm3
Melting Point: 54 °C
Boiling Point: 292 °C at 760 mmHg
Flash Point: 123.4 °C
Hazard Symbols: Xn,Xi
Risk Codes: R20/21/22; R36/37/38
Safety: 24/25
PSA: 53.99000
LogP: 1.88910
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  • Ethyl 3,4,5-trimethoxybenzoate

  • Casno:

    6178-44-5

    Ethyl 3,4,5-trimethoxybenzoate

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    3,4,5-Trimethoxybenzoic acid ethyl ester

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  • Ethyl 3,4,5-trimethoxybenzoate

  • Casno:

    6178-44-5

    Ethyl 3,4,5-trimethoxybenzoate

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    High purity Application:Screening the references, analyzing the expectant ingredients

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Chemistry

Molecule structure of Ethyl 3,4,5-trimethoxybenzoate (CAS NO.6178-44-5):

IUPAC Name: Ethyl 3,4,5-trimethoxybenzoate 
Molecular Weight: 240.25244 [g/mol]
Molecular Formula: C12H16O5 
Index of Refraction: 1.492
Molar Refractivity: 62.69 cm3
Molar Volume: 215.8 cm3
Surface Tension: 34.1 dyne/cm
Density: 1.113 g/cm3 
Melting Point: 54 °C
Flash Point: 123.4 °C
Enthalpy of Vaporization: 53.14 kJ/mol
Boiling Point: 292 °C at 760 mmHg
Vapour Pressure: 0.00189 mmHg at 25 °C
XLogP3-AA: 2.1
H-Bond Acceptor: 5
Rotatable Bond Count: 6
Exact Mass: 240.099774
MonoIsotopic Mass: 240.099774
Topological Polar Surface Area: 54
Heavy Atom Count: 17
Canonical SMILES: CCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC
InChI: InChI=1S/C12H16O5/c1-5-17-12(13)8-6-9(14-2)11(16-4)10(7-8)15-3/h6-7H,5H2,1-4H3
InChIKey: UEOFNBCUGJADBM-UHFFFAOYSA-N
Product Categories: Aromatic Esters

Uses

 Ethyl 3,4,5-trimethoxybenzoate (CAS NO.6178-44-5) is used as food additives and pharmaceutical intermediates.

Specification

 Ethyl 3,4,5-trimethoxybenzoate (CAS NO.6178-44-5) is also named as Nenzoic acid, 3,4,5-trimethoxy-, ethyl ester ; 3,4,5-Trimethoxybenzoic acid ethyl ester ; Ethyl 3,4,5-trimethoxy benzoate ; Ethyl-3,4,5-trimethoxybenzoat .