2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde

C15H12O2Se2 — CID 58121719

IUPAC2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde
SMILESO=Cc1ccccc1[Se]C[Se]c1ccccc1C=O
InChIInChI=1S/C15H12O2Se2/c16-9-12-5-1-3-7-14(12)18-11-19-15-8-4-2-6-13(15)10-17/h1-10H,11H2
InChIKeyDTMFNWIYIDBKPC-UHFFFAOYSA-N
MW382.18 g/mol
LogP1.05
Rot. Bonds6

About 2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde

2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde (PubChem CID 58121719) has the molecular formula C15H12O2Se2 and a molecular weight of 382.18 g/mol. Its IUPAC name is 2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde.

Molecular Properties

Compound Name2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde
PubChem CID58121719
Molecular FormulaC15H12O2Se2
Molecular Weight382.18 g/mol
Exact Mass383.92
IUPAC Name2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde
SMILESO=Cc1ccccc1[Se]C[Se]c1ccccc1C=O
InChIInChI=1S/C15H12O2Se2/c16-9-12-5-1-3-7-14(12)18-11-19-15-8-4-2-6-13(15)10-17/h1-10H,11H2
InChIKeyDTMFNWIYIDBKPC-UHFFFAOYSA-N
XLogP1.05
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.18
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde?
The IUPAC name of 2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde (CID 58121719) is 2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde.
What is the SMILES notation for 2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde?
The canonical SMILES for 2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde is O=Cc1ccccc1[Se]C[Se]c1ccccc1C=O.
What is the InChIKey of 2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde?
The InChIKey is DTMFNWIYIDBKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12O2Se2/c16-9-12-5-1-3-7-14(12)18-11-19-15-8-4-2-6-13(15)10-17/h1-10H,11H2.
What are the key properties of 2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde?
2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde has a molecular weight of 382.18 g/mol, XLogP of 1.05, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-formylphenyl)selanylmethylselanyl]benzaldehyde is sourced from PubChem (CID 58121719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).