CID 19763861

C14H21BrSi — CID 19763861

IUPAC—
SMILESCCCC([Si]C(C)(C)C)c1ccc(Br)cc1
InChIInChI=1S/C14H21BrSi/c1-5-6-13(16-14(2,3)4)11-7-9-12(15)10-8-11/h7-10,13H,5-6H2,1-4H3
InChIKeyZQCJGPDYUPKUCN-UHFFFAOYSA-N
MW297.31 g/mol
LogP5.21
Rot. Bonds4

About CID 19763861

CID 19763861 (PubChem CID 19763861) has the molecular formula C14H21BrSi and a molecular weight of 297.31 g/mol.

Molecular Properties

Compound NameCID 19763861
PubChem CID19763861
Molecular FormulaC14H21BrSi
Molecular Weight297.31 g/mol
Exact Mass296.06
IUPAC Name—
SMILESCCCC([Si]C(C)(C)C)c1ccc(Br)cc1
InChIInChI=1S/C14H21BrSi/c1-5-6-13(16-14(2,3)4)11-7-9-12(15)10-8-11/h7-10,13H,5-6H2,1-4H3
InChIKeyZQCJGPDYUPKUCN-UHFFFAOYSA-N
XLogP5.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.31
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 19763861?
The IUPAC name of CID 19763861 (CID 19763861) is not available.
What is the SMILES notation for CID 19763861?
The canonical SMILES for CID 19763861 is CCCC([Si]C(C)(C)C)c1ccc(Br)cc1.
What is the InChIKey of CID 19763861?
The InChIKey is ZQCJGPDYUPKUCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21BrSi/c1-5-6-13(16-14(2,3)4)11-7-9-12(15)10-8-11/h7-10,13H,5-6H2,1-4H3.
What are the key properties of CID 19763861?
CID 19763861 has a molecular weight of 297.31 g/mol, XLogP of 5.21, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 19763861 is sourced from PubChem (CID 19763861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).