2-ethyl-6-(methoxymethoxy)benzaldehyde

C11H14O3 — CID 59509177

IUPAC2-ethyl-6-(methoxymethoxy)benzaldehyde
SMILESCCc1cccc(OCOC)c1C=O
InChIInChI=1S/C11H14O3/c1-3-9-5-4-6-11(10(9)7-12)14-8-13-2/h4-7H,3,8H2,1-2H3
InChIKeyVCSOLGRDKHRLSI-UHFFFAOYSA-N
MW194.23 g/mol
LogP2.04
Rot. Bonds5

About 2-ethyl-6-(methoxymethoxy)benzaldehyde

2-ethyl-6-(methoxymethoxy)benzaldehyde (PubChem CID 59509177) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-ethyl-6-(methoxymethoxy)benzaldehyde.

Molecular Properties

Compound Name2-ethyl-6-(methoxymethoxy)benzaldehyde
PubChem CID59509177
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Name2-ethyl-6-(methoxymethoxy)benzaldehyde
SMILESCCc1cccc(OCOC)c1C=O
InChIInChI=1S/C11H14O3/c1-3-9-5-4-6-11(10(9)7-12)14-8-13-2/h4-7H,3,8H2,1-2H3
InChIKeyVCSOLGRDKHRLSI-UHFFFAOYSA-N
XLogP2.04
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

3,6-dimethoxy-2-[2-methoxy-6-(methoxymethoxy)phenyl]benzaldehyde
CID 135012085
2-[2,6-bis(methoxymethoxy)phenyl]-3,6-dimethoxybenzaldehyde
CID 135029975
2-ethyl-1,3-bis(methoxymethoxy)benzene
CID 141101427
2-fluoro-6-[2-(methoxymethoxy)phenyl]benzaldehyde
CID 172649734
N-[2-formyl-3-(methoxymethoxy)phenyl]-2,2-dimethylpropanamide
CID 21082663
2-bromo-3-(methoxymethoxy)benzaldehyde
CID 59515258
2-methoxy-6-(methoxymethoxy)-3-methylbenzaldehyde
CID 86226921
2-chloro-3-(chloromethyl)pyridine;2-[(2-chloro-3-pyridinyl)methoxy]-6-(methoxymethoxy)benzaldehyde;2-hydroxy-6-(methoxymethoxy)benzaldehyde;methane
CID 157459600
2-ethyl-6-methylbenzaldehyde;1,4-xylene
CID 143282659
2-[2,6-bis(methoxymethoxy)phenyl]-3-hydroxy-6-phenylmethoxybenzaldehyde
CID 135029831
3-methoxy-2-(methoxymethoxy)benzaldehyde
CID 11644081
[2-(methoxymethoxy)phenyl]methanol
CID 10920904

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-(methoxymethoxy)benzaldehyde?
The IUPAC name of 2-ethyl-6-(methoxymethoxy)benzaldehyde (CID 59509177) is 2-ethyl-6-(methoxymethoxy)benzaldehyde.
What is the SMILES notation for 2-ethyl-6-(methoxymethoxy)benzaldehyde?
The canonical SMILES for 2-ethyl-6-(methoxymethoxy)benzaldehyde is CCc1cccc(OCOC)c1C=O.
What is the InChIKey of 2-ethyl-6-(methoxymethoxy)benzaldehyde?
The InChIKey is VCSOLGRDKHRLSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3/c1-3-9-5-4-6-11(10(9)7-12)14-8-13-2/h4-7H,3,8H2,1-2H3.
What are the key properties of 2-ethyl-6-(methoxymethoxy)benzaldehyde?
2-ethyl-6-(methoxymethoxy)benzaldehyde has a molecular weight of 194.23 g/mol, XLogP of 2.04, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-(methoxymethoxy)benzaldehyde is sourced from PubChem (CID 59509177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).