(tetraphenyl-λ5-phosphanyl) chlorate

C24H20ClO3P — CID 88762177

IUPAC(tetraphenyl-λ5-phosphanyl) chlorate
SMILES[O-][Cl+2]([O-])OP(c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H20ClO3P/c26-25(27)28-29(21-13-5-1-6-14-21,22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKeyBNASXFTXKIUFOQ-UHFFFAOYSA-N
MW422.85 g/mol
LogP1.86
Rot. Bonds6

About (tetraphenyl-λ5-phosphanyl) chlorate

(tetraphenyl-λ5-phosphanyl) chlorate (PubChem CID 88762177) has the molecular formula C24H20ClO3P and a molecular weight of 422.85 g/mol. Its IUPAC name is (tetraphenyl-λ5-phosphanyl) chlorate.

Molecular Properties

Compound Name(tetraphenyl-λ5-phosphanyl) chlorate
PubChem CID88762177
Molecular FormulaC24H20ClO3P
Molecular Weight422.85 g/mol
Exact Mass422.08
IUPAC Name(tetraphenyl-λ5-phosphanyl) chlorate
SMILES[O-][Cl+2]([O-])OP(c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H20ClO3P/c26-25(27)28-29(21-13-5-1-6-14-21,22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKeyBNASXFTXKIUFOQ-UHFFFAOYSA-N
XLogP1.86
TPSA55.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.85
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (tetraphenyl-λ5-phosphanyl) chlorate?
The IUPAC name of (tetraphenyl-λ5-phosphanyl) chlorate (CID 88762177) is (tetraphenyl-λ5-phosphanyl) chlorate.
What is the SMILES notation for (tetraphenyl-λ5-phosphanyl) chlorate?
The canonical SMILES for (tetraphenyl-λ5-phosphanyl) chlorate is [O-][Cl+2]([O-])OP(c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (tetraphenyl-λ5-phosphanyl) chlorate?
The InChIKey is BNASXFTXKIUFOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20ClO3P/c26-25(27)28-29(21-13-5-1-6-14-21,22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H.
What are the key properties of (tetraphenyl-λ5-phosphanyl) chlorate?
(tetraphenyl-λ5-phosphanyl) chlorate has a molecular weight of 422.85 g/mol, XLogP of 1.86, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (tetraphenyl-λ5-phosphanyl) chlorate is sourced from PubChem (CID 88762177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).