chempirical

2,5-Dimethoxyterephthalaldehyde

C10H10O4CAS 7310-97-6194.19 g/mol

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AldehydeEther

Properties

Molecular formula
C10H10O4
Molar mass
194.19 g/mol
Exact mass
194.0579 Da
logP
1.33Crippen estimate
Polar surface area
52.6 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
7310-97-6
SMILES
COC1=CC(=C(C=C1C=O)OC)C=O
InChIKey
YSIIHTHHMPYKFP-UHFFFAOYSA-N
InChI
InChI=1S/C10H10O4/c1-13-9-3-8(6-12)10(14-2)4-7(9)5-11/h3-6H,1-2H3

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Work with 2,5-Dimethoxyterephthalaldehyde

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,4,5-Trimethoxybenzaldehyde4460-86-091 % similar 4-Bromo-2,5-dimethoxybenzaldehyde31558-41-574 % similar 4,5-Difluoro-2-methoxybenzaldehyde145742-34-370 % similar 3,3'-Dimethoxy-[1,1'-biphenyl]-4,4'-dicarbaldehyde27343-98-267 % similar 2,5-Dimethoxybenzaldehyde93-02-767 % similar 6-Bromoveratraldehyde5392-10-964 % similar 2,4-Dimethoxybenzaldehyde613-45-664 % similar 2-Fluoro-4,5-dimethoxybenzaldehyde71924-62-464 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1,3-Dihydroxybenzene diacetate108-58-7 Ferulic acid1135-24-6 1,4-Diacetoxybenzene1205-91-0 Dimethyl terephthalate120-61-6 Dimethyl phthalate131-11-3 Dimethyl isophthalate1459-93-4 Methyl 5-acetylsalicylate16475-90-4 3-Acetoxy-O-toluic acid168899-58-9

Elsewhere

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