chloro-ethoxy-bis(1H-inden-1-yl)silane

C20H19ClOSi — CID 18688520

IUPACchloro-ethoxy-bis(1H-inden-1-yl)silane
SMILESCCO[Si](Cl)(C1C=Cc2ccccc21)C1C=Cc2ccccc21
InChIInChI=1S/C20H19ClOSi/c1-2-22-23(21,19-13-11-15-7-3-5-9-17(15)19)20-14-12-16-8-4-6-10-18(16)20/h3-14,19-20H,2H2,1H3
InChIKeyJFBPFTXSGLUDKU-UHFFFAOYSA-N
MW338.91 g/mol
LogP5.40
Rot. Bonds4

About chloro-ethoxy-bis(1H-inden-1-yl)silane

chloro-ethoxy-bis(1H-inden-1-yl)silane (PubChem CID 18688520) has the molecular formula C20H19ClOSi and a molecular weight of 338.91 g/mol. Its IUPAC name is chloro-ethoxy-bis(1H-inden-1-yl)silane.

Molecular Properties

Compound Namechloro-ethoxy-bis(1H-inden-1-yl)silane
PubChem CID18688520
Molecular FormulaC20H19ClOSi
Molecular Weight338.91 g/mol
Exact Mass338.09
IUPAC Namechloro-ethoxy-bis(1H-inden-1-yl)silane
SMILESCCO[Si](Cl)(C1C=Cc2ccccc21)C1C=Cc2ccccc21
InChIInChI=1S/C20H19ClOSi/c1-2-22-23(21,19-13-11-15-7-3-5-9-17(15)19)20-14-12-16-8-4-6-10-18(16)20/h3-14,19-20H,2H2,1H3
InChIKeyJFBPFTXSGLUDKU-UHFFFAOYSA-N
XLogP5.40
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.91
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze chloro-ethoxy-bis(1H-inden-1-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-ethoxy-bis(1H-inden-1-yl)silane?
The IUPAC name of chloro-ethoxy-bis(1H-inden-1-yl)silane (CID 18688520) is chloro-ethoxy-bis(1H-inden-1-yl)silane.
What is the SMILES notation for chloro-ethoxy-bis(1H-inden-1-yl)silane?
The canonical SMILES for chloro-ethoxy-bis(1H-inden-1-yl)silane is CCO[Si](Cl)(C1C=Cc2ccccc21)C1C=Cc2ccccc21.
What is the InChIKey of chloro-ethoxy-bis(1H-inden-1-yl)silane?
The InChIKey is JFBPFTXSGLUDKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClOSi/c1-2-22-23(21,19-13-11-15-7-3-5-9-17(15)19)20-14-12-16-8-4-6-10-18(16)20/h3-14,19-20H,2H2,1H3.
What are the key properties of chloro-ethoxy-bis(1H-inden-1-yl)silane?
chloro-ethoxy-bis(1H-inden-1-yl)silane has a molecular weight of 338.91 g/mol, XLogP of 5.40, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-ethoxy-bis(1H-inden-1-yl)silane is sourced from PubChem (CID 18688520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).