trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane

C10H17Cl3Si — CID 22401829

IUPACtrichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane
SMILESC=CCC1CCC(C)C([Si](Cl)(Cl)Cl)C1
InChIInChI=1S/C10H17Cl3Si/c1-3-4-9-6-5-8(2)10(7-9)14(11,12)13/h3,8-10H,1,4-7H2,2H3
InChIKeyFVLVCJIGEKUBFO-UHFFFAOYSA-N
MW271.69 g/mol
LogP5.02
Rot. Bonds3

About trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane

trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane (PubChem CID 22401829) has the molecular formula C10H17Cl3Si and a molecular weight of 271.69 g/mol. Its IUPAC name is trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane.

Molecular Properties

Compound Nametrichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane
PubChem CID22401829
Molecular FormulaC10H17Cl3Si
Molecular Weight271.69 g/mol
Exact Mass270.02
IUPAC Nametrichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane
SMILESC=CCC1CCC(C)C([Si](Cl)(Cl)Cl)C1
InChIInChI=1S/C10H17Cl3Si/c1-3-4-9-6-5-8(2)10(7-9)14(11,12)13/h3,8-10H,1,4-7H2,2H3
InChIKeyFVLVCJIGEKUBFO-UHFFFAOYSA-N
XLogP5.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500271.69
LogP ≤ 55.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze trichloro-(2-methyl-5-prop-2-enylcyclohexyl)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 trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane?
The IUPAC name of trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane (CID 22401829) is trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane.
What is the SMILES notation for trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane?
The canonical SMILES for trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane is C=CCC1CCC(C)C([Si](Cl)(Cl)Cl)C1.
What is the InChIKey of trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane?
The InChIKey is FVLVCJIGEKUBFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17Cl3Si/c1-3-4-9-6-5-8(2)10(7-9)14(11,12)13/h3,8-10H,1,4-7H2,2H3.
What are the key properties of trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane?
trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane has a molecular weight of 271.69 g/mol, XLogP of 5.02, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro-(2-methyl-5-prop-2-enylcyclohexyl)silane is sourced from PubChem (CID 22401829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).