(3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane

C22H23P — CID 129275176

IUPAC(3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane
SMILESCc1ccc(P(c2ccc(C)cc2)c2cc(C)cc(C)c2)cc1
InChIInChI=1S/C22H23P/c1-16-5-9-20(10-6-16)23(21-11-7-17(2)8-12-21)22-14-18(3)13-19(4)15-22/h5-15H,1-4H3
InChIKeyRVOGBKCBLIGHSC-UHFFFAOYSA-N
MW318.40 g/mol
LogP4.68
Rot. Bonds3

About (3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane

(3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane (PubChem CID 129275176) has the molecular formula C22H23P and a molecular weight of 318.40 g/mol. Its IUPAC name is (3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane.

Molecular Properties

Compound Name(3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane
PubChem CID129275176
Molecular FormulaC22H23P
Molecular Weight318.40 g/mol
Exact Mass318.15
IUPAC Name(3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane
SMILESCc1ccc(P(c2ccc(C)cc2)c2cc(C)cc(C)c2)cc1
InChIInChI=1S/C22H23P/c1-16-5-9-20(10-6-16)23(21-11-7-17(2)8-12-21)22-14-18(3)13-19(4)15-22/h5-15H,1-4H3
InChIKeyRVOGBKCBLIGHSC-UHFFFAOYSA-N
XLogP4.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.40
LogP ≤ 54.68
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 (3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane?
The IUPAC name of (3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane (CID 129275176) is (3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane.
What is the SMILES notation for (3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane?
The canonical SMILES for (3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane is Cc1ccc(P(c2ccc(C)cc2)c2cc(C)cc(C)c2)cc1.
What is the InChIKey of (3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane?
The InChIKey is RVOGBKCBLIGHSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23P/c1-16-5-9-20(10-6-16)23(21-11-7-17(2)8-12-21)22-14-18(3)13-19(4)15-22/h5-15H,1-4H3.
What are the key properties of (3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane?
(3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane has a molecular weight of 318.40 g/mol, XLogP of 4.68, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylphenyl)-bis(4-methylphenyl)phosphane is sourced from PubChem (CID 129275176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).