cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane

C22H26Si — CID 174657129

IUPACcyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane
SMILESC[Si](c1ccccc1)(C1CCCCC1)C1C=Cc2ccccc21
InChIInChI=1S/C22H26Si/c1-23(19-11-4-2-5-12-19,20-13-6-3-7-14-20)22-17-16-18-10-8-9-15-21(18)22/h2,4-5,8-12,15-17,20,22H,3,6-7,13-14H2,1H3
InChIKeyCZBVTMFRQQPAAC-UHFFFAOYSA-N
MW318.54 g/mol
LogP5.66
Rot. Bonds3

About cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane

cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane (PubChem CID 174657129) has the molecular formula C22H26Si and a molecular weight of 318.54 g/mol. Its IUPAC name is cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane.

Molecular Properties

Compound Namecyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane
PubChem CID174657129
Molecular FormulaC22H26Si
Molecular Weight318.54 g/mol
Exact Mass318.18
IUPAC Namecyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane
SMILESC[Si](c1ccccc1)(C1CCCCC1)C1C=Cc2ccccc21
InChIInChI=1S/C22H26Si/c1-23(19-11-4-2-5-12-19,20-13-6-3-7-14-20)22-17-16-18-10-8-9-15-21(18)22/h2,4-5,8-12,15-17,20,22H,3,6-7,13-14H2,1H3
InChIKeyCZBVTMFRQQPAAC-UHFFFAOYSA-N
XLogP5.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.54
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane?
The IUPAC name of cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane (CID 174657129) is cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane.
What is the SMILES notation for cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane?
The canonical SMILES for cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane is C[Si](c1ccccc1)(C1CCCCC1)C1C=Cc2ccccc21.
What is the InChIKey of cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane?
The InChIKey is CZBVTMFRQQPAAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26Si/c1-23(19-11-4-2-5-12-19,20-13-6-3-7-14-20)22-17-16-18-10-8-9-15-21(18)22/h2,4-5,8-12,15-17,20,22H,3,6-7,13-14H2,1H3.
What are the key properties of cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane?
cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane has a molecular weight of 318.54 g/mol, XLogP of 5.66, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-(1H-inden-1-yl)-methyl-phenylsilane is sourced from PubChem (CID 174657129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).