bis(3,5-dimethylphenyl)phosphane

C16H19P — CID 4185969

IUPACbis(3,5-dimethylphenyl)phosphane
SMILESCc1cc(C)cc(Pc2cc(C)cc(C)c2)c1
InChIInChI=1S/C16H19P/c1-11-5-12(2)8-15(7-11)17-16-9-13(3)6-14(4)10-16/h5-10,17H,1-4H3
InChIKeyGPFIUEZTNRNFGD-UHFFFAOYSA-N
MW242.30 g/mol
LogP3.55
Rot. Bonds2

About bis(3,5-dimethylphenyl)phosphane

bis(3,5-dimethylphenyl)phosphane (PubChem CID 4185969) has the molecular formula C16H19P and a molecular weight of 242.30 g/mol. Its IUPAC name is bis(3,5-dimethylphenyl)phosphane.

Molecular Properties

Compound Namebis(3,5-dimethylphenyl)phosphane
PubChem CID4185969
Molecular FormulaC16H19P
Molecular Weight242.30 g/mol
Exact Mass242.12
IUPAC Namebis(3,5-dimethylphenyl)phosphane
SMILESCc1cc(C)cc(Pc2cc(C)cc(C)c2)c1
InChIInChI=1S/C16H19P/c1-11-5-12(2)8-15(7-11)17-16-9-13(3)6-14(4)10-16/h5-10,17H,1-4H3
InChIKeyGPFIUEZTNRNFGD-UHFFFAOYSA-N
XLogP3.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(3,5-dimethylphenyl)phosphane?
The IUPAC name of bis(3,5-dimethylphenyl)phosphane (CID 4185969) is bis(3,5-dimethylphenyl)phosphane.
What is the SMILES notation for bis(3,5-dimethylphenyl)phosphane?
The canonical SMILES for bis(3,5-dimethylphenyl)phosphane is Cc1cc(C)cc(Pc2cc(C)cc(C)c2)c1.
What is the InChIKey of bis(3,5-dimethylphenyl)phosphane?
The InChIKey is GPFIUEZTNRNFGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19P/c1-11-5-12(2)8-15(7-11)17-16-9-13(3)6-14(4)10-16/h5-10,17H,1-4H3.
What are the key properties of bis(3,5-dimethylphenyl)phosphane?
bis(3,5-dimethylphenyl)phosphane has a molecular weight of 242.30 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3,5-dimethylphenyl)phosphane is sourced from PubChem (CID 4185969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).