chloro-bis(1H-inden-1-yl)-methoxysilane

C19H17ClOSi — CID 18688384

IUPACchloro-bis(1H-inden-1-yl)-methoxysilane
SMILESCO[Si](Cl)(C1C=Cc2ccccc21)C1C=Cc2ccccc21
InChIInChI=1S/C19H17ClOSi/c1-21-22(20,18-12-10-14-6-2-4-8-16(14)18)19-13-11-15-7-3-5-9-17(15)19/h2-13,18-19H,1H3
InChIKeyJJPHLUPEZQPQRD-UHFFFAOYSA-N
MW324.88 g/mol
LogP5.01
Rot. Bonds3

About chloro-bis(1H-inden-1-yl)-methoxysilane

chloro-bis(1H-inden-1-yl)-methoxysilane (PubChem CID 18688384) has the molecular formula C19H17ClOSi and a molecular weight of 324.88 g/mol. Its IUPAC name is chloro-bis(1H-inden-1-yl)-methoxysilane.

Molecular Properties

Compound Namechloro-bis(1H-inden-1-yl)-methoxysilane
PubChem CID18688384
Molecular FormulaC19H17ClOSi
Molecular Weight324.88 g/mol
Exact Mass324.07
IUPAC Namechloro-bis(1H-inden-1-yl)-methoxysilane
SMILESCO[Si](Cl)(C1C=Cc2ccccc21)C1C=Cc2ccccc21
InChIInChI=1S/C19H17ClOSi/c1-21-22(20,18-12-10-14-6-2-4-8-16(14)18)19-13-11-15-7-3-5-9-17(15)19/h2-13,18-19H,1H3
InChIKeyJJPHLUPEZQPQRD-UHFFFAOYSA-N
XLogP5.01
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.88
LogP ≤ 55.01
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'}

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Frequently Asked Questions

What is the IUPAC name of chloro-bis(1H-inden-1-yl)-methoxysilane?
The IUPAC name of chloro-bis(1H-inden-1-yl)-methoxysilane (CID 18688384) is chloro-bis(1H-inden-1-yl)-methoxysilane.
What is the SMILES notation for chloro-bis(1H-inden-1-yl)-methoxysilane?
The canonical SMILES for chloro-bis(1H-inden-1-yl)-methoxysilane is CO[Si](Cl)(C1C=Cc2ccccc21)C1C=Cc2ccccc21.
What is the InChIKey of chloro-bis(1H-inden-1-yl)-methoxysilane?
The InChIKey is JJPHLUPEZQPQRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClOSi/c1-21-22(20,18-12-10-14-6-2-4-8-16(14)18)19-13-11-15-7-3-5-9-17(15)19/h2-13,18-19H,1H3.
What are the key properties of chloro-bis(1H-inden-1-yl)-methoxysilane?
chloro-bis(1H-inden-1-yl)-methoxysilane has a molecular weight of 324.88 g/mol, XLogP of 5.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-bis(1H-inden-1-yl)-methoxysilane is sourced from PubChem (CID 18688384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).