benzene;bis(4-methylphenyl)phosphane

C20H21P — CID 159425906

IUPACbenzene;bis(4-methylphenyl)phosphane
SMILESCc1ccc(Pc2ccc(C)cc2)cc1.c1ccccc1
InChIInChI=1S/C14H15P.C6H6/c1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-2-4-6-5-3-1/h3-10,15H,1-2H3;1-6H
InChIKeyLQIUBKXISNZMBK-UHFFFAOYSA-N
MW292.36 g/mol
LogP4.62
Rot. Bonds2

About benzene;bis(4-methylphenyl)phosphane

benzene;bis(4-methylphenyl)phosphane (PubChem CID 159425906) has the molecular formula C20H21P and a molecular weight of 292.36 g/mol. Its IUPAC name is benzene;bis(4-methylphenyl)phosphane.

Molecular Properties

Compound Namebenzene;bis(4-methylphenyl)phosphane
PubChem CID159425906
Molecular FormulaC20H21P
Molecular Weight292.36 g/mol
Exact Mass292.14
IUPAC Namebenzene;bis(4-methylphenyl)phosphane
SMILESCc1ccc(Pc2ccc(C)cc2)cc1.c1ccccc1
InChIInChI=1S/C14H15P.C6H6/c1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-2-4-6-5-3-1/h3-10,15H,1-2H3;1-6H
InChIKeyLQIUBKXISNZMBK-UHFFFAOYSA-N
XLogP4.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 54.62
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

bis(4-methylphenyl)phosphane;hydrofluoride
CID 175567589
diphenylphosphane;toluene;hydrochloride
CID 174856667
benzene;bis(1,4-xylene)
CID 159472747
(3,5-dimethylphenyl)-phenylphosphane
CID 22961936
(4-methylphenyl)-(2-methyl-4-phenylphenyl)phosphane
CID 118112401
diphenylphosphane;zinc
CID 160591319
radon;toluene;1,4-xylene
CID 174747246
bis(diphenylphosphane);zinc
CID 160732089
benzene;ethane;1-methyl-4-(4-methylphenyl)benzene
CID 161197560
benzene;toluene
CID 158487474
methylcyclotriacontapentadecaene
CID 101240530
titanium(2+);toluene
CID 22023820

Frequently Asked Questions

What is the IUPAC name of benzene;bis(4-methylphenyl)phosphane?
The IUPAC name of benzene;bis(4-methylphenyl)phosphane (CID 159425906) is benzene;bis(4-methylphenyl)phosphane.
What is the SMILES notation for benzene;bis(4-methylphenyl)phosphane?
The canonical SMILES for benzene;bis(4-methylphenyl)phosphane is Cc1ccc(Pc2ccc(C)cc2)cc1.c1ccccc1.
What is the InChIKey of benzene;bis(4-methylphenyl)phosphane?
The InChIKey is LQIUBKXISNZMBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15P.C6H6/c1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-2-4-6-5-3-1/h3-10,15H,1-2H3;1-6H.
What are the key properties of benzene;bis(4-methylphenyl)phosphane?
benzene;bis(4-methylphenyl)phosphane has a molecular weight of 292.36 g/mol, XLogP of 4.62, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;bis(4-methylphenyl)phosphane is sourced from PubChem (CID 159425906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).