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Chemical structure of 3,4,5-Trimethoxybenzaldehyde

GC61675

3,4,5-Trimethoxybenzaldehyde

Also known as 3,4,5-trimethoxybenzaldehyde

3,4,5-Trimethoxybenzaldehyde is an intermediate for the synthesis of various pharmaceuticals, especially for?trimethoprim?used to treat bacterial infections, including urinary tract pathogens infection

ChemicalCAS86-81-7MW196.2FormulaC10H12O4
CAS number
86-81-7
Molecular weight
196.2
Formula
C10H12O4
Solubility
DMSO ： 50 mg/mL (254·84 mM; Need ultrasonic)
InChIKey
OPHQOIGEOHXOGX-UHFFFAOYSA-N
Catalogue number
GC61675
Brand
GLPBIO
Computed properties PubChem CID 6858 · XLogP 0.9 · TPSA 44.8 Ų · H-bond donors 0
XLogP
0.9
TPSA
44.8 Ų
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
14

SMILES COC1=CC(=CC(=C1OC)OC)C=O

Computed descriptors from PubChem (CID 6858), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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