2,4-dimethoxybenzene-1,3-dicarbaldehyde

C10H10O4 — CID 11615337

IUPAC2,4-dimethoxybenzene-1,3-dicarbaldehyde
SMILESCOc1ccc(C=O)c(OC)c1C=O
InChIInChI=1S/C10H10O4/c1-13-9-4-3-7(5-11)10(14-2)8(9)6-12/h3-6H,1-2H3
InChIKeyIFEHNGDBFMBCQW-UHFFFAOYSA-N
MW194.19 g/mol
LogP1.33
Rot. Bonds4

About 2,4-dimethoxybenzene-1,3-dicarbaldehyde

2,4-dimethoxybenzene-1,3-dicarbaldehyde (PubChem CID 11615337) has the molecular formula C10H10O4 and a molecular weight of 194.19 g/mol. Its IUPAC name is 2,4-dimethoxybenzene-1,3-dicarbaldehyde.

Molecular Properties

Compound Name2,4-dimethoxybenzene-1,3-dicarbaldehyde
PubChem CID11615337
Molecular FormulaC10H10O4
Molecular Weight194.19 g/mol
Exact Mass194.06
IUPAC Name2,4-dimethoxybenzene-1,3-dicarbaldehyde
SMILESCOc1ccc(C=O)c(OC)c1C=O
InChIInChI=1S/C10H10O4/c1-13-9-4-3-7(5-11)10(14-2)8(9)6-12/h3-6H,1-2H3
InChIKeyIFEHNGDBFMBCQW-UHFFFAOYSA-N
XLogP1.33
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 2,4-dimethoxybenzene-1,3-dicarbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-chloro-2,6-dimethoxybenzaldehyde
CID 15414486
4-bromo-2-methoxybenzene-1,3-dicarbaldehyde
CID 171003528
2-bromo-3,6-dimethoxybenzaldehyde
CID 11356987
6-chloro-2,3-dimethoxybenzaldehyde
CID 19389247
3-hydroxy-4-methoxy-2-prop-2-enoxybenzaldehyde
CID 86025869
2,6-dimethoxynaphthalene-1-carbaldehyde
CID 12583354
7-methoxyisoquinoline-8-carbaldehyde
CID 82573729
3,4-diformyl-2-methoxybenzonitrile
CID 171028234
2,3-dimethoxybenzaldehyde;2,5-dimethoxybenzaldehyde
CID 161122515
5-methoxy-1-methylindazole-4-carbaldehyde
CID 84662481
4-methoxy-2-methylindazole-7-carbaldehyde
CID 117110206
2-hydroxy-6-(3-hydroxyprop-1-enyl)-3-methoxybenzaldehyde
CID 169453822

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxybenzene-1,3-dicarbaldehyde?
The IUPAC name of 2,4-dimethoxybenzene-1,3-dicarbaldehyde (CID 11615337) is 2,4-dimethoxybenzene-1,3-dicarbaldehyde.
What is the SMILES notation for 2,4-dimethoxybenzene-1,3-dicarbaldehyde?
The canonical SMILES for 2,4-dimethoxybenzene-1,3-dicarbaldehyde is COc1ccc(C=O)c(OC)c1C=O.
What is the InChIKey of 2,4-dimethoxybenzene-1,3-dicarbaldehyde?
The InChIKey is IFEHNGDBFMBCQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O4/c1-13-9-4-3-7(5-11)10(14-2)8(9)6-12/h3-6H,1-2H3.
What are the key properties of 2,4-dimethoxybenzene-1,3-dicarbaldehyde?
2,4-dimethoxybenzene-1,3-dicarbaldehyde has a molecular weight of 194.19 g/mol, XLogP of 1.33, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxybenzene-1,3-dicarbaldehyde is sourced from PubChem (CID 11615337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).