1,1,2-triphenyl-3H-phosphindole

C26H21P — CID 135051318

IUPAC1,1,2-triphenyl-3H-phosphindole
SMILESc1ccc(C2=P(c3ccccc3)(c3ccccc3)c3ccccc3C2)cc1
InChIInChI=1S/C26H21P/c1-4-12-21(13-5-1)26-20-22-14-10-11-19-25(22)27(26,23-15-6-2-7-16-23)24-17-8-3-9-18-24/h1-19H,20H2
InChIKeyNLGFACAQQLDGAU-UHFFFAOYSA-N
MW364.43 g/mol
LogP4.76
Rot. Bonds3

About 1,1,2-triphenyl-3H-phosphindole

1,1,2-triphenyl-3H-phosphindole (PubChem CID 135051318) has the molecular formula C26H21P and a molecular weight of 364.43 g/mol. Its IUPAC name is 1,1,2-triphenyl-3H-phosphindole.

Molecular Properties

Compound Name1,1,2-triphenyl-3H-phosphindole
PubChem CID135051318
Molecular FormulaC26H21P
Molecular Weight364.43 g/mol
Exact Mass364.14
IUPAC Name1,1,2-triphenyl-3H-phosphindole
SMILESc1ccc(C2=P(c3ccccc3)(c3ccccc3)c3ccccc3C2)cc1
InChIInChI=1S/C26H21P/c1-4-12-21(13-5-1)26-20-22-14-10-11-19-25(22)27(26,23-15-6-2-7-16-23)24-17-8-3-9-18-24/h1-19H,20H2
InChIKeyNLGFACAQQLDGAU-UHFFFAOYSA-N
XLogP4.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.43
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

bicyclo[8.1.0]undeca-1,3,5,7,9-pentaene
CID 91124939
(1R)-1-phenyl-2,3-dihydrophosphindole 1-oxide
CID 139092919
1,1'-biphenyl;9H-fluorene;hydrazine
CID 157286275
benzene;tris(1,1'-biphenyl)
CID 162155747
2-(4-phenylphenyl)-1H-indene;zirconium
CID 174373323
1,2-diphenyl-3H-2,1λ5-benzazaphosphole 1-oxide
CID 13037520
bicyclo[4.1.0]hepta-1,3,5-triene;methane
CID 157397080
1,1'-biphenyl;cycloheptane
CID 174877368
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
1,1'-biphenyl;mercury
CID 67099988
1,1'-biphenyl;hydrofluoride
CID 67516975
bis(1,1'-biphenyl);sulfane
CID 22247507

Frequently Asked Questions

What is the IUPAC name of 1,1,2-triphenyl-3H-phosphindole?
The IUPAC name of 1,1,2-triphenyl-3H-phosphindole (CID 135051318) is 1,1,2-triphenyl-3H-phosphindole.
What is the SMILES notation for 1,1,2-triphenyl-3H-phosphindole?
The canonical SMILES for 1,1,2-triphenyl-3H-phosphindole is c1ccc(C2=P(c3ccccc3)(c3ccccc3)c3ccccc3C2)cc1.
What is the InChIKey of 1,1,2-triphenyl-3H-phosphindole?
The InChIKey is NLGFACAQQLDGAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21P/c1-4-12-21(13-5-1)26-20-22-14-10-11-19-25(22)27(26,23-15-6-2-7-16-23)24-17-8-3-9-18-24/h1-19H,20H2.
What are the key properties of 1,1,2-triphenyl-3H-phosphindole?
1,1,2-triphenyl-3H-phosphindole has a molecular weight of 364.43 g/mol, XLogP of 4.76, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2-triphenyl-3H-phosphindole is sourced from PubChem (CID 135051318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).