4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde

C14H10F2O2 — CID 91658405

IUPAC4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde
SMILESO=Cc1ccc(F)cc1OCc1ccccc1F
InChIInChI=1S/C14H10F2O2/c15-12-6-5-10(8-17)14(7-12)18-9-11-3-1-2-4-13(11)16/h1-8H,9H2
InChIKeyGOPSVGPASLJTKM-UHFFFAOYSA-N
MW248.23 g/mol
LogP3.36
Rot. Bonds4

About 4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde

4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde (PubChem CID 91658405) has the molecular formula C14H10F2O2 and a molecular weight of 248.23 g/mol. Its IUPAC name is 4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde.

Molecular Properties

Compound Name4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde
PubChem CID91658405
Molecular FormulaC14H10F2O2
Molecular Weight248.23 g/mol
Exact Mass248.06
IUPAC Name4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde
SMILESO=Cc1ccc(F)cc1OCc1ccccc1F
InChIInChI=1S/C14H10F2O2/c15-12-6-5-10(8-17)14(7-12)18-9-11-3-1-2-4-13(11)16/h1-8H,9H2
InChIKeyGOPSVGPASLJTKM-UHFFFAOYSA-N
XLogP3.36
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.23
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(2-fluorophenyl)methoxy]benzaldehyde
CID 2063523
2-[(2,4-difluorophenoxy)methyl]benzaldehyde
CID 87366498
2-[(2,3-difluorophenyl)methoxy]-5-fluorobenzaldehyde
CID 107697829
1-bromo-4-fluoro-2-[(2-fluorophenyl)methoxy]benzene
CID 79020415
2-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxybenzaldehyde
CID 883669
2-[(2,5-difluorophenyl)methoxy]-3-fluorobenzaldehyde
CID 112611763
4-fluoro-2-propoxybenzaldehyde
CID 74889364
2-[(2,6-difluorophenyl)methoxy]benzaldehyde
CID 103978417
2-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorobenzaldehyde
CID 107697199
2-[(2-chloro-3-fluorophenyl)methoxy]-4-methoxybenzaldehyde
CID 115886848
2-[(3,5-difluorophenyl)methoxy]benzaldehyde
CID 105403637
4,5-difluoro-2-phenylmethoxybenzaldehyde
CID 129164784

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde?
The IUPAC name of 4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde (CID 91658405) is 4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde.
What is the SMILES notation for 4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde?
The canonical SMILES for 4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde is O=Cc1ccc(F)cc1OCc1ccccc1F.
What is the InChIKey of 4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde?
The InChIKey is GOPSVGPASLJTKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2O2/c15-12-6-5-10(8-17)14(7-12)18-9-11-3-1-2-4-13(11)16/h1-8H,9H2.
What are the key properties of 4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde?
4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde has a molecular weight of 248.23 g/mol, XLogP of 3.36, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-[(2-fluorophenyl)methoxy]benzaldehyde is sourced from PubChem (CID 91658405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).