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Structure

Ethyl 3,4,5-Trimethoxybenzoate

CAS
6178-44-5
Catalog Number
ACM6178445
Category
Other Products
Molecular Weight
240.3
Molecular Formula
C12H16O5

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Specification

Synonyms
NSC26825, ZINC01634150, ST5406898, 6178-44-5
IUPAC Name
ethyl 3,4,5-trimethoxybenzoate
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
InChI Key
UEOFNBCUGJADBM-UHFFFAOYSA-N
Boiling Point
292ºC at 760 mmHg
Melting Point
54ºC
Flash Point
123.4ºC
Density
1.113 g/cm³
Appearance
Powder
Exact Mass
240.10000
Hazard Statements
Xn,Xi
H-Bond Acceptor
5
H-Bond Donor
0
Packing Group
III
Safety Description
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
WGK Germany
3
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