2-(dimethoxymethyl)-6-methoxybenzaldehyde

C11H14O4 — CID 10443088

IUPAC2-(dimethoxymethyl)-6-methoxybenzaldehyde
SMILESCOc1cccc(C(OC)OC)c1C=O
InChIInChI=1S/C11H14O4/c1-13-10-6-4-5-8(9(10)7-12)11(14-2)15-3/h4-7,11H,1-3H3
InChIKeyUNAKPZUFXZRYES-UHFFFAOYSA-N
MW210.23 g/mol
LogP1.80
Rot. Bonds5

About 2-(dimethoxymethyl)-6-methoxybenzaldehyde

2-(dimethoxymethyl)-6-methoxybenzaldehyde (PubChem CID 10443088) has the molecular formula C11H14O4 and a molecular weight of 210.23 g/mol. Its IUPAC name is 2-(dimethoxymethyl)-6-methoxybenzaldehyde.

Molecular Properties

Compound Name2-(dimethoxymethyl)-6-methoxybenzaldehyde
PubChem CID10443088
Molecular FormulaC11H14O4
Molecular Weight210.23 g/mol
Exact Mass210.09
IUPAC Name2-(dimethoxymethyl)-6-methoxybenzaldehyde
SMILESCOc1cccc(C(OC)OC)c1C=O
InChIInChI=1S/C11H14O4/c1-13-10-6-4-5-8(9(10)7-12)11(14-2)15-3/h4-7,11H,1-3H3
InChIKeyUNAKPZUFXZRYES-UHFFFAOYSA-N
XLogP1.80
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-(2-formylphenoxy)-6-methoxybenzaldehyde
CID 102334226
2-formyl-3-methoxybenzonitrile
CID 122401577
2,6-dimethoxybenzaldehyde;4-hydroxybenzaldehyde
CID 159655150
3-(2,6-dimethoxyphenyl)prop-2-enal
CID 54191678
2-ethenyl-3-methoxybenzaldehyde
CID 10487197
2-[(1E,4E)-5-(2,6-dimethoxyphenyl)-3-oxopenta-1,4-dienyl]-3-methoxybenzaldehyde
CID 126587171
2-(3-methoxy-2-nitrophenyl)propanal
CID 134639975
2-(2-hydroxy-3-methoxyphenyl)propanal
CID 83828156
2-bromo-3,6-dimethoxybenzaldehyde
CID 11356987
2-(2-formyl-6-methoxyphenyl)-3-methoxybenzaldehyde
CID 15694387
3,6-dimethoxy-2-[2-methoxy-6-(methoxymethoxy)phenyl]benzaldehyde
CID 135012085
2-(hydroxymethyl)-2-methylpropane-1,3-diol;3-methoxyphthalaldehyde
CID 175477698

Frequently Asked Questions

What is the IUPAC name of 2-(dimethoxymethyl)-6-methoxybenzaldehyde?
The IUPAC name of 2-(dimethoxymethyl)-6-methoxybenzaldehyde (CID 10443088) is 2-(dimethoxymethyl)-6-methoxybenzaldehyde.
What is the SMILES notation for 2-(dimethoxymethyl)-6-methoxybenzaldehyde?
The canonical SMILES for 2-(dimethoxymethyl)-6-methoxybenzaldehyde is COc1cccc(C(OC)OC)c1C=O.
What is the InChIKey of 2-(dimethoxymethyl)-6-methoxybenzaldehyde?
The InChIKey is UNAKPZUFXZRYES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O4/c1-13-10-6-4-5-8(9(10)7-12)11(14-2)15-3/h4-7,11H,1-3H3.
What are the key properties of 2-(dimethoxymethyl)-6-methoxybenzaldehyde?
2-(dimethoxymethyl)-6-methoxybenzaldehyde has a molecular weight of 210.23 g/mol, XLogP of 1.80, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethoxymethyl)-6-methoxybenzaldehyde is sourced from PubChem (CID 10443088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).