chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane

C13H17ClSi — CID 142448765

IUPACchloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane
SMILESCC1=C([Si](C)(C)Cl)C(C)c2ccccc21
InChIInChI=1S/C13H17ClSi/c1-9-11-7-5-6-8-12(11)10(2)13(9)15(3,4)14/h5-9H,1-4H3
InChIKeyANXICAANNVXBFH-UHFFFAOYSA-N
MW236.82 g/mol
LogP4.56
Rot. Bonds1

About chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane

chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane (PubChem CID 142448765) has the molecular formula C13H17ClSi and a molecular weight of 236.82 g/mol. Its IUPAC name is chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane.

Molecular Properties

Compound Namechloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane
PubChem CID142448765
Molecular FormulaC13H17ClSi
Molecular Weight236.82 g/mol
Exact Mass236.08
IUPAC Namechloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane
SMILESCC1=C([Si](C)(C)Cl)C(C)c2ccccc21
InChIInChI=1S/C13H17ClSi/c1-9-11-7-5-6-8-12(11)10(2)13(9)15(3,4)14/h5-9H,1-4H3
InChIKeyANXICAANNVXBFH-UHFFFAOYSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.82
LogP ≤ 54.56
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'}

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Frequently Asked Questions

What is the IUPAC name of chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane?
The IUPAC name of chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane (CID 142448765) is chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane.
What is the SMILES notation for chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane?
The canonical SMILES for chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane is CC1=C([Si](C)(C)Cl)C(C)c2ccccc21.
What is the InChIKey of chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane?
The InChIKey is ANXICAANNVXBFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClSi/c1-9-11-7-5-6-8-12(11)10(2)13(9)15(3,4)14/h5-9H,1-4H3.
What are the key properties of chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane?
chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane has a molecular weight of 236.82 g/mol, XLogP of 4.56, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(1,3-dimethyl-1H-inden-2-yl)-dimethylsilane is sourced from PubChem (CID 142448765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).