CID 163286836

C12H7INSi — CID 163286836

IUPAC—
SMILES[Si]n1c2ccccc2c2cc(I)ccc21
InChIInChI=1S/C12H7INSi/c13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14(12)15/h1-7H
InChIKeyGKFCGQOMVFPJNK-UHFFFAOYSA-N
MW320.19 g/mol
LogP3.33
Rot. Bonds

About CID 163286836

CID 163286836 (PubChem CID 163286836) has the molecular formula C12H7INSi and a molecular weight of 320.19 g/mol.

Molecular Properties

Compound NameCID 163286836
PubChem CID163286836
Molecular FormulaC12H7INSi
Molecular Weight320.19 g/mol
Exact Mass319.94
IUPAC Name—
SMILES[Si]n1c2ccccc2c2cc(I)ccc21
InChIInChI=1S/C12H7INSi/c13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14(12)15/h1-7H
InChIKeyGKFCGQOMVFPJNK-UHFFFAOYSA-N
XLogP3.33
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.19
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 163286836?
The IUPAC name of CID 163286836 (CID 163286836) is not available.
What is the SMILES notation for CID 163286836?
The canonical SMILES for CID 163286836 is [Si]n1c2ccccc2c2cc(I)ccc21.
What is the InChIKey of CID 163286836?
The InChIKey is GKFCGQOMVFPJNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7INSi/c13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14(12)15/h1-7H.
What are the key properties of CID 163286836?
CID 163286836 has a molecular weight of 320.19 g/mol, XLogP of 3.33, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 163286836 is sourced from PubChem (CID 163286836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).