triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane

C36H28NP — CID 101426516

IUPACtriphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane
SMILESc1ccc(-c2ccc(-c3ccc(N=P(c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C36H28NP/c1-5-13-29(14-6-1)30-21-23-31(24-22-30)32-25-27-33(28-26-32)37-38(34-15-7-2-8-16-34,35-17-9-3-10-18-35)36-19-11-4-12-20-36/h1-28H
InChIKeySBVUICLXYOZAJM-UHFFFAOYSA-N
MW505.60 g/mol
LogP8.83
Rot. Bonds6

About triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane

triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane (PubChem CID 101426516) has the molecular formula C36H28NP and a molecular weight of 505.60 g/mol. Its IUPAC name is triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane.

Molecular Properties

Compound Nametriphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane
PubChem CID101426516
Molecular FormulaC36H28NP
Molecular Weight505.60 g/mol
Exact Mass505.20
IUPAC Nametriphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane
SMILESc1ccc(-c2ccc(-c3ccc(N=P(c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C36H28NP/c1-5-13-29(14-6-1)30-21-23-31(24-22-30)32-25-27-33(28-26-32)37-38(34-15-7-2-8-16-34,35-17-9-3-10-18-35)36-19-11-4-12-20-36/h1-28H
InChIKeySBVUICLXYOZAJM-UHFFFAOYSA-N
XLogP8.83
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500505.60
LogP ≤ 58.83
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

5-[4-[(triphenyl-λ5-phosphanylidene)amino]phenyl]benzene-1,3-diamine
CID 134505269
4-[(triphenyl-λ5-phosphanylidene)amino]benzoic acid
CID 11452277
N,N-diethyl-4-[(triphenyl-λ5-phosphanylidene)amino]aniline
CID 134935584
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
1-[methyl-(4-phenylphenyl)phosphoryl]-4-phenylbenzene
CID 14298647
1-isocyanato-4-(4-phenylphenyl)benzene
CID 146595382
[2-methoxy-4-[(triphenyl-λ5-phosphanylidene)amino]phenyl]imino-triphenyl-λ5-phosphane
CID 89330602
benzene;tris(1,1'-biphenyl)
CID 162155747
(2,3,4,5,6-pentafluorophenyl)imino-triphenyl-λ5-phosphane
CID 71362132
(2E,6E)-4-methyl-2,6-bis[[4-[(triphenyl-λ5-phosphanylidene)amino]phenyl]methylidene]cyclohexan-1-one
CID 102583657
1,4-bis[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]benzene;ethane;1-phenyl-4-[4-[4-[4-[4-[4-[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 162041275
[5-[diphenyl-(4-propan-2-ylphenyl)imino-λ5-phosphanyl]pyrrol-1-id-2-yl]-diphenyl-(4-propan-2-ylphenyl)imino-λ5-phosphane;ethene;rhodium
CID 139186699

Frequently Asked Questions

What is the IUPAC name of triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane?
The IUPAC name of triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane (CID 101426516) is triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane.
What is the SMILES notation for triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane?
The canonical SMILES for triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane is c1ccc(-c2ccc(-c3ccc(N=P(c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)cc1.
What is the InChIKey of triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane?
The InChIKey is SBVUICLXYOZAJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H28NP/c1-5-13-29(14-6-1)30-21-23-31(24-22-30)32-25-27-33(28-26-32)37-38(34-15-7-2-8-16-34,35-17-9-3-10-18-35)36-19-11-4-12-20-36/h1-28H.
What are the key properties of triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane?
triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane has a molecular weight of 505.60 g/mol, XLogP of 8.83, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl-[4-(4-phenylphenyl)phenyl]imino-λ5-phosphane is sourced from PubChem (CID 101426516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).