CID 155601533

C8H7FISi — CID 155601533

IUPAC—
SMILESFc1ccc(I)cc1CC[Si]
InChIInChI=1S/C8H7FISi/c9-8-2-1-7(10)5-6(8)3-4-11/h1-2,5H,3-4H2
InChIKeyKYNZATRQYZCJNP-UHFFFAOYSA-N
MW277.13 g/mol
LogP2.56
Rot. Bonds2

About CID 155601533

CID 155601533 (PubChem CID 155601533) has the molecular formula C8H7FISi and a molecular weight of 277.13 g/mol.

Molecular Properties

Compound NameCID 155601533
PubChem CID155601533
Molecular FormulaC8H7FISi
Molecular Weight277.13 g/mol
Exact Mass276.93
IUPAC Name—
SMILESFc1ccc(I)cc1CC[Si]
InChIInChI=1S/C8H7FISi/c9-8-2-1-7(10)5-6(8)3-4-11/h1-2,5H,3-4H2
InChIKeyKYNZATRQYZCJNP-UHFFFAOYSA-N
XLogP2.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.13
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 155601533?
The IUPAC name of CID 155601533 (CID 155601533) is not available.
What is the SMILES notation for CID 155601533?
The canonical SMILES for CID 155601533 is Fc1ccc(I)cc1CC[Si].
What is the InChIKey of CID 155601533?
The InChIKey is KYNZATRQYZCJNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FISi/c9-8-2-1-7(10)5-6(8)3-4-11/h1-2,5H,3-4H2.
What are the key properties of CID 155601533?
CID 155601533 has a molecular weight of 277.13 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155601533 is sourced from PubChem (CID 155601533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).