CID 158857215

C16H20Si — CID 158857215

IUPAC—
SMILESCCCC.c1ccc([Si]c2ccccc2)cc1
InChIInChI=1S/C12H10Si.C4H10/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-4-2/h1-10H;3-4H2,1-2H3
InChIKeyJAFBDDPNOWDJHY-UHFFFAOYSA-N
MW240.42 g/mol
LogP3.15
Rot. Bonds3

About CID 158857215

CID 158857215 (PubChem CID 158857215) has the molecular formula C16H20Si and a molecular weight of 240.42 g/mol.

Molecular Properties

Compound NameCID 158857215
PubChem CID158857215
Molecular FormulaC16H20Si
Molecular Weight240.42 g/mol
Exact Mass240.13
IUPAC Name—
SMILESCCCC.c1ccc([Si]c2ccccc2)cc1
InChIInChI=1S/C12H10Si.C4H10/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-4-2/h1-10H;3-4H2,1-2H3
InChIKeyJAFBDDPNOWDJHY-UHFFFAOYSA-N
XLogP3.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.42
LogP ≤ 53.15
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 CID 158857215?
The IUPAC name of CID 158857215 (CID 158857215) is not available.
What is the SMILES notation for CID 158857215?
The canonical SMILES for CID 158857215 is CCCC.c1ccc([Si]c2ccccc2)cc1.
What is the InChIKey of CID 158857215?
The InChIKey is JAFBDDPNOWDJHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Si.C4H10/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-4-2/h1-10H;3-4H2,1-2H3.
What are the key properties of CID 158857215?
CID 158857215 has a molecular weight of 240.42 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 158857215 is sourced from PubChem (CID 158857215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).