2-(2-formylphenyl)benzaldehyde

C14H10O2 — CID 14585

IUPAC2-(2-formylphenyl)benzaldehyde
SMILESO=Cc1ccccc1-c1ccccc1C=O
InChIInChI=1S/C14H10O2/c15-9-11-5-1-3-7-13(11)14-8-4-2-6-12(14)10-16/h1-10H
InChIKeyHJFGULDHUDIPDA-UHFFFAOYSA-N
MW210.23 g/mol
LogP2.98
Rot. Bonds3

About 2-(2-formylphenyl)benzaldehyde

2-(2-formylphenyl)benzaldehyde (PubChem CID 14585) has the molecular formula C14H10O2 and a molecular weight of 210.23 g/mol. Its IUPAC name is 2-(2-formylphenyl)benzaldehyde.

Molecular Properties

Compound Name2-(2-formylphenyl)benzaldehyde
PubChem CID14585
Molecular FormulaC14H10O2
Molecular Weight210.23 g/mol
Exact Mass210.07
IUPAC Name2-(2-formylphenyl)benzaldehyde
SMILESO=Cc1ccccc1-c1ccccc1C=O
InChIInChI=1S/C14H10O2/c15-9-11-5-1-3-7-13(11)14-8-4-2-6-12(14)10-16/h1-10H
InChIKeyHJFGULDHUDIPDA-UHFFFAOYSA-N
XLogP2.98
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 52.98
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-(2-formylphenyl)benzaldehyde?
The IUPAC name of 2-(2-formylphenyl)benzaldehyde (CID 14585) is 2-(2-formylphenyl)benzaldehyde.
What is the SMILES notation for 2-(2-formylphenyl)benzaldehyde?
The canonical SMILES for 2-(2-formylphenyl)benzaldehyde is O=Cc1ccccc1-c1ccccc1C=O.
What is the InChIKey of 2-(2-formylphenyl)benzaldehyde?
The InChIKey is HJFGULDHUDIPDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10O2/c15-9-11-5-1-3-7-13(11)14-8-4-2-6-12(14)10-16/h1-10H.
What are the key properties of 2-(2-formylphenyl)benzaldehyde?
2-(2-formylphenyl)benzaldehyde has a molecular weight of 210.23 g/mol, XLogP of 2.98, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-formylphenyl)benzaldehyde is sourced from PubChem (CID 14585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).