2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde

C24H16O2 — CID 10806790

IUPAC2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde
SMILESO=Cc1ccccc1-c1ccc(-c2ccccc2C=O)c2ccccc12
InChIInChI=1S/C24H16O2/c25-15-17-7-1-3-9-19(17)23-13-14-24(22-12-6-5-11-21(22)23)20-10-4-2-8-18(20)16-26/h1-16H
InChIKeyPJQPYTKIOSMIGH-UHFFFAOYSA-N
MW336.39 g/mol
LogP5.80
Rot. Bonds4

About 2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde

2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde (PubChem CID 10806790) has the molecular formula C24H16O2 and a molecular weight of 336.39 g/mol. Its IUPAC name is 2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde.

Molecular Properties

Compound Name2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde
PubChem CID10806790
Molecular FormulaC24H16O2
Molecular Weight336.39 g/mol
Exact Mass336.12
IUPAC Name2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde
SMILESO=Cc1ccccc1-c1ccc(-c2ccccc2C=O)c2ccccc12
InChIInChI=1S/C24H16O2/c25-15-17-7-1-3-9-19(17)23-13-14-24(22-12-6-5-11-21(22)23)20-10-4-2-8-18(20)16-26/h1-16H
InChIKeyPJQPYTKIOSMIGH-UHFFFAOYSA-N
XLogP5.80
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.39
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde?
The IUPAC name of 2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde (CID 10806790) is 2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde.
What is the SMILES notation for 2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde?
The canonical SMILES for 2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde is O=Cc1ccccc1-c1ccc(-c2ccccc2C=O)c2ccccc12.
What is the InChIKey of 2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde?
The InChIKey is PJQPYTKIOSMIGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16O2/c25-15-17-7-1-3-9-19(17)23-13-14-24(22-12-6-5-11-21(22)23)20-10-4-2-8-18(20)16-26/h1-16H.
What are the key properties of 2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde?
2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde has a molecular weight of 336.39 g/mol, XLogP of 5.80, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-formylphenyl)naphthalen-1-yl]benzaldehyde is sourced from PubChem (CID 10806790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).