bis(4-formylphenyl) phenyl phosphite

C20H15O5P — CID 146390093

IUPACbis(4-formylphenyl) phenyl phosphite
SMILESO=Cc1ccc(OP(Oc2ccccc2)Oc2ccc(C=O)cc2)cc1
InChIInChI=1S/C20H15O5P/c21-14-16-6-10-19(11-7-16)24-26(23-18-4-2-1-3-5-18)25-20-12-8-17(15-22)9-13-20/h1-15H
InChIKeyDGGBLWOSJAZOCK-UHFFFAOYSA-N
MW366.31 g/mol
LogP5.08
Rot. Bonds8

About bis(4-formylphenyl) phenyl phosphite

bis(4-formylphenyl) phenyl phosphite (PubChem CID 146390093) has the molecular formula C20H15O5P and a molecular weight of 366.31 g/mol. Its IUPAC name is bis(4-formylphenyl) phenyl phosphite.

Molecular Properties

Compound Namebis(4-formylphenyl) phenyl phosphite
PubChem CID146390093
Molecular FormulaC20H15O5P
Molecular Weight366.31 g/mol
Exact Mass366.07
IUPAC Namebis(4-formylphenyl) phenyl phosphite
SMILESO=Cc1ccc(OP(Oc2ccccc2)Oc2ccc(C=O)cc2)cc1
InChIInChI=1S/C20H15O5P/c21-14-16-6-10-19(11-7-16)24-26(23-18-4-2-1-3-5-18)25-20-12-8-17(15-22)9-13-20/h1-15H
InChIKeyDGGBLWOSJAZOCK-UHFFFAOYSA-N
XLogP5.08
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.31
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(4-formylphenyl) phenyl phosphite?
The IUPAC name of bis(4-formylphenyl) phenyl phosphite (CID 146390093) is bis(4-formylphenyl) phenyl phosphite.
What is the SMILES notation for bis(4-formylphenyl) phenyl phosphite?
The canonical SMILES for bis(4-formylphenyl) phenyl phosphite is O=Cc1ccc(OP(Oc2ccccc2)Oc2ccc(C=O)cc2)cc1.
What is the InChIKey of bis(4-formylphenyl) phenyl phosphite?
The InChIKey is DGGBLWOSJAZOCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15O5P/c21-14-16-6-10-19(11-7-16)24-26(23-18-4-2-1-3-5-18)25-20-12-8-17(15-22)9-13-20/h1-15H.
What are the key properties of bis(4-formylphenyl) phenyl phosphite?
bis(4-formylphenyl) phenyl phosphite has a molecular weight of 366.31 g/mol, XLogP of 5.08, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-formylphenyl) phenyl phosphite is sourced from PubChem (CID 146390093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).