(4-ethenylphenyl)-bis(2-methylphenyl)phosphane

C22H21P — CID 87621287

IUPAC(4-ethenylphenyl)-bis(2-methylphenyl)phosphane
SMILESC=Cc1ccc(P(c2ccccc2C)c2ccccc2C)cc1
InChIInChI=1S/C22H21P/c1-4-19-13-15-20(16-14-19)23(21-11-7-5-9-17(21)2)22-12-8-6-10-18(22)3/h4-16H,1H2,2-3H3
InChIKeyLBTDMPMLTUUQSK-UHFFFAOYSA-N
MW316.38 g/mol
LogP4.70
Rot. Bonds4

About (4-ethenylphenyl)-bis(2-methylphenyl)phosphane

(4-ethenylphenyl)-bis(2-methylphenyl)phosphane (PubChem CID 87621287) has the molecular formula C22H21P and a molecular weight of 316.38 g/mol. Its IUPAC name is (4-ethenylphenyl)-bis(2-methylphenyl)phosphane.

Molecular Properties

Compound Name(4-ethenylphenyl)-bis(2-methylphenyl)phosphane
PubChem CID87621287
Molecular FormulaC22H21P
Molecular Weight316.38 g/mol
Exact Mass316.14
IUPAC Name(4-ethenylphenyl)-bis(2-methylphenyl)phosphane
SMILESC=Cc1ccc(P(c2ccccc2C)c2ccccc2C)cc1
InChIInChI=1S/C22H21P/c1-4-19-13-15-20(16-14-19)23(21-11-7-5-9-17(21)2)22-12-8-6-10-18(22)3/h4-16H,1H2,2-3H3
InChIKeyLBTDMPMLTUUQSK-UHFFFAOYSA-N
XLogP4.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 54.70
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 (4-ethenylphenyl)-bis(2-methylphenyl)phosphane?
The IUPAC name of (4-ethenylphenyl)-bis(2-methylphenyl)phosphane (CID 87621287) is (4-ethenylphenyl)-bis(2-methylphenyl)phosphane.
What is the SMILES notation for (4-ethenylphenyl)-bis(2-methylphenyl)phosphane?
The canonical SMILES for (4-ethenylphenyl)-bis(2-methylphenyl)phosphane is C=Cc1ccc(P(c2ccccc2C)c2ccccc2C)cc1.
What is the InChIKey of (4-ethenylphenyl)-bis(2-methylphenyl)phosphane?
The InChIKey is LBTDMPMLTUUQSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21P/c1-4-19-13-15-20(16-14-19)23(21-11-7-5-9-17(21)2)22-12-8-6-10-18(22)3/h4-16H,1H2,2-3H3.
What are the key properties of (4-ethenylphenyl)-bis(2-methylphenyl)phosphane?
(4-ethenylphenyl)-bis(2-methylphenyl)phosphane has a molecular weight of 316.38 g/mol, XLogP of 4.70, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethenylphenyl)-bis(2-methylphenyl)phosphane is sourced from PubChem (CID 87621287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).