chloro-(4-phenylphenyl)-di(propan-2-yl)silane

C18H23ClSi — CID 2724946

IUPACchloro-(4-phenylphenyl)-di(propan-2-yl)silane
SMILESCC(C)[Si](Cl)(c1ccc(-c2ccccc2)cc1)C(C)C
InChIInChI=1S/C18H23ClSi/c1-14(2)20(19,15(3)4)18-12-10-17(11-13-18)16-8-6-5-7-9-16/h5-15H,1-4H3
InChIKeySKDGQTFEGJDSMQ-UHFFFAOYSA-N
MW302.92 g/mol
LogP5.56
Rot. Bonds4

About chloro-(4-phenylphenyl)-di(propan-2-yl)silane

chloro-(4-phenylphenyl)-di(propan-2-yl)silane (PubChem CID 2724946) has the molecular formula C18H23ClSi and a molecular weight of 302.92 g/mol. Its IUPAC name is chloro-(4-phenylphenyl)-di(propan-2-yl)silane.

Molecular Properties

Compound Namechloro-(4-phenylphenyl)-di(propan-2-yl)silane
PubChem CID2724946
Molecular FormulaC18H23ClSi
Molecular Weight302.92 g/mol
Exact Mass302.13
IUPAC Namechloro-(4-phenylphenyl)-di(propan-2-yl)silane
SMILESCC(C)[Si](Cl)(c1ccc(-c2ccccc2)cc1)C(C)C
InChIInChI=1S/C18H23ClSi/c1-14(2)20(19,15(3)4)18-12-10-17(11-13-18)16-8-6-5-7-9-16/h5-15H,1-4H3
InChIKeySKDGQTFEGJDSMQ-UHFFFAOYSA-N
XLogP5.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.92
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze chloro-(4-phenylphenyl)-di(propan-2-yl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of chloro-(4-phenylphenyl)-di(propan-2-yl)silane?
The IUPAC name of chloro-(4-phenylphenyl)-di(propan-2-yl)silane (CID 2724946) is chloro-(4-phenylphenyl)-di(propan-2-yl)silane.
What is the SMILES notation for chloro-(4-phenylphenyl)-di(propan-2-yl)silane?
The canonical SMILES for chloro-(4-phenylphenyl)-di(propan-2-yl)silane is CC(C)[Si](Cl)(c1ccc(-c2ccccc2)cc1)C(C)C.
What is the InChIKey of chloro-(4-phenylphenyl)-di(propan-2-yl)silane?
The InChIKey is SKDGQTFEGJDSMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23ClSi/c1-14(2)20(19,15(3)4)18-12-10-17(11-13-18)16-8-6-5-7-9-16/h5-15H,1-4H3.
What are the key properties of chloro-(4-phenylphenyl)-di(propan-2-yl)silane?
chloro-(4-phenylphenyl)-di(propan-2-yl)silane has a molecular weight of 302.92 g/mol, XLogP of 5.56, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(4-phenylphenyl)-di(propan-2-yl)silane is sourced from PubChem (CID 2724946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).