1,2,3-triphenylisophosphindole 2-oxide

C26H19OP — CID 135051366

IUPAC1,2,3-triphenylisophosphindole 2-oxide
SMILESO=P1(c2ccccc2)C(c2ccccc2)=c2ccccc2=C1c1ccccc1
InChIInChI=1S/C26H19OP/c27-28(22-16-8-3-9-17-22)25(20-12-4-1-5-13-20)23-18-10-11-19-24(23)26(28)21-14-6-2-7-15-21/h1-19H
InChIKeyXASHJPUVNRAMHX-UHFFFAOYSA-N
MW378.41 g/mol
LogP4.70
Rot. Bonds3

About 1,2,3-triphenylisophosphindole 2-oxide

1,2,3-triphenylisophosphindole 2-oxide (PubChem CID 135051366) has the molecular formula C26H19OP and a molecular weight of 378.41 g/mol. Its IUPAC name is 1,2,3-triphenylisophosphindole 2-oxide.

Molecular Properties

Compound Name1,2,3-triphenylisophosphindole 2-oxide
PubChem CID135051366
Molecular FormulaC26H19OP
Molecular Weight378.41 g/mol
Exact Mass378.12
IUPAC Name1,2,3-triphenylisophosphindole 2-oxide
SMILESO=P1(c2ccccc2)C(c2ccccc2)=c2ccccc2=C1c1ccccc1
InChIInChI=1S/C26H19OP/c27-28(22-16-8-3-9-17-22)25(20-12-4-1-5-13-20)23-18-10-11-19-24(23)26(28)21-14-6-2-7-15-21/h1-19H
InChIKeyXASHJPUVNRAMHX-UHFFFAOYSA-N
XLogP4.70
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.41
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 102391294
1-phenyl-2,3,4,5-tetrakis[5-[4-(trifluoromethyl)phenyl]thiophen-2-yl]-1λ5-phosphole 1-oxide
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3-bromo-2-(4-chlorophenyl)-1-phenylphosphindole 1-oxide
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bis(1,1'-biphenyl);phosphonous acid
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2,3,7,8-tetramethyl-5,10-diphenylphosphanthrene 5,10-dioxide
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10-phenyl-5H-phenophosphazinine 10-oxide
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2-phenyl-1,3,2λ5-benzodithiaphosphole 2-oxide
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benzene;tris(1,1'-biphenyl)
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2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-10-phenylbenzo[b][1,4]benzothiaphosphinine 10-oxide
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Frequently Asked Questions

What is the IUPAC name of 1,2,3-triphenylisophosphindole 2-oxide?
The IUPAC name of 1,2,3-triphenylisophosphindole 2-oxide (CID 135051366) is 1,2,3-triphenylisophosphindole 2-oxide.
What is the SMILES notation for 1,2,3-triphenylisophosphindole 2-oxide?
The canonical SMILES for 1,2,3-triphenylisophosphindole 2-oxide is O=P1(c2ccccc2)C(c2ccccc2)=c2ccccc2=C1c1ccccc1.
What is the InChIKey of 1,2,3-triphenylisophosphindole 2-oxide?
The InChIKey is XASHJPUVNRAMHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19OP/c27-28(22-16-8-3-9-17-22)25(20-12-4-1-5-13-20)23-18-10-11-19-24(23)26(28)21-14-6-2-7-15-21/h1-19H.
What are the key properties of 1,2,3-triphenylisophosphindole 2-oxide?
1,2,3-triphenylisophosphindole 2-oxide has a molecular weight of 378.41 g/mol, XLogP of 4.70, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3-triphenylisophosphindole 2-oxide is sourced from PubChem (CID 135051366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).