chempirical

2,3,4-Trimethoxy-6-methylbenzaldehyde

C11H14O4CAS 22383-85-3210.23 g/mol

Open in Covalent MOL file
OOOO
AldehydeEther

Properties

Molecular formula
C11H14O4
Molar mass
210.23 g/mol
Exact mass
210.0892 Da
Melting point
61–61.4 °C
logP
1.83Crippen estimate
Polar surface area
44.8 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
22383-85-3
SMILES
COc1cc(C)c(C=O)c(OC)c1OC
InChIKey
OMDNFMOQYYDECR-UHFFFAOYSA-N
InChI
InChI=1S/C11H14O4/c1-7-5-9(13-2)11(15-4)10(14-3)8(7)6-12/h5-6H,1-4H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names
  • Benzaldehyde, 2,3,4-trimethoxy-6-methyl-
  • o-Tolualdehyde, 4,5,6-trimethoxy-
  • 2-Methyl-4,5,6-trimethoxybenzaldehyde
  • 4,5,6-Trimethoxy-o-tolualdehyde

Work with 2,3,4-Trimethoxy-6-methylbenzaldehyde

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

4-Methoxy-2,3,6-trimethylbenzaldehyde54344-92-265 % similar 2,3,4,5-Tetramethoxytoluene35896-58-358 % similar 4-Methoxy-2,5-dimethylbenzaldehyde6745-75-156 % similar 3,4,5-Trimethoxybenzaldehyde86-81-755 % similar 4-Methoxy-3,5-dimethylbenzaldehyde39250-90-353 % similar 2,3,4-Trimethoxy-6-methylphenol39068-88-751 % similar 3-Iodo-4,5-dimethoxybenzaldehyde32024-15-050 % similar 2,4,6-Trimethoxybenzaldehyde830-79-550 % similar

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

Same formula

3-(2,3-Dimethoxyphenyl)propanoic acid10538-48-4 3-(2,5-Dimethoxyphenyl)propionic acid10538-49-5 3',4',5'-Trimethoxyacetophenone1136-86-3 4-Ethoxy-3-methoxybenzeneacetic acid120-13-8 2',3',4'-Trimethoxyacetophenone13909-73-4 3-(3,4-Dimethoxyphenyl)propionic acid2107-70-2 3,4-Diethoxybenzoic acid5409-31-4 2,4-Dihydroxy-6-propyl-benzoic acid methyl ester55382-52-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook