chloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane

C17H17ClSi — CID 142448788

IUPACchloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane
SMILESC[Si](C)(Cl)C1=C(c2ccccc2)c2ccccc2C1
InChIInChI=1S/C17H17ClSi/c1-19(2,18)16-12-14-10-6-7-11-15(14)17(16)13-8-4-3-5-9-13/h3-11H,12H2,1-2H3
InChIKeyBWORMOZSXQEZQZ-UHFFFAOYSA-N
MW284.86 g/mol
LogP5.03
Rot. Bonds2

About chloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane

chloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane (PubChem CID 142448788) has the molecular formula C17H17ClSi and a molecular weight of 284.86 g/mol. Its IUPAC name is chloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane.

Molecular Properties

Compound Namechloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane
PubChem CID142448788
Molecular FormulaC17H17ClSi
Molecular Weight284.86 g/mol
Exact Mass284.08
IUPAC Namechloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane
SMILESC[Si](C)(Cl)C1=C(c2ccccc2)c2ccccc2C1
InChIInChI=1S/C17H17ClSi/c1-19(2,18)16-12-14-10-6-7-11-15(14)17(16)13-8-4-3-5-9-13/h3-11H,12H2,1-2H3
InChIKeyBWORMOZSXQEZQZ-UHFFFAOYSA-N
XLogP5.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.86
LogP ≤ 55.03
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-dimethyl-(3-phenyl-1H-inden-2-yl)silane?
The IUPAC name of chloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane (CID 142448788) is chloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane.
What is the SMILES notation for chloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane?
The canonical SMILES for chloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane is C[Si](C)(Cl)C1=C(c2ccccc2)c2ccccc2C1.
What is the InChIKey of chloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane?
The InChIKey is BWORMOZSXQEZQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClSi/c1-19(2,18)16-12-14-10-6-7-11-15(14)17(16)13-8-4-3-5-9-13/h3-11H,12H2,1-2H3.
What are the key properties of chloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane?
chloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane has a molecular weight of 284.86 g/mol, XLogP of 5.03, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-dimethyl-(3-phenyl-1H-inden-2-yl)silane is sourced from PubChem (CID 142448788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).