CID 178036170

C10H12Cl2FSi — CID 178036170

IUPAC—
SMILESFC(CCC[Si](Cl)Cl)c1ccccc1
InChIInChI=1S/C10H12Cl2FSi/c11-14(12)8-4-7-10(13)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2
InChIKeyZRGVFGHQECEEHP-UHFFFAOYSA-N
MW250.20 g/mol
LogP4.44
Rot. Bonds5

About CID 178036170

CID 178036170 (PubChem CID 178036170) has the molecular formula C10H12Cl2FSi and a molecular weight of 250.20 g/mol.

Molecular Properties

Compound NameCID 178036170
PubChem CID178036170
Molecular FormulaC10H12Cl2FSi
Molecular Weight250.20 g/mol
Exact Mass249.01
IUPAC Name—
SMILESFC(CCC[Si](Cl)Cl)c1ccccc1
InChIInChI=1S/C10H12Cl2FSi/c11-14(12)8-4-7-10(13)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2
InChIKeyZRGVFGHQECEEHP-UHFFFAOYSA-N
XLogP4.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.20
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 178036170?
The IUPAC name of CID 178036170 (CID 178036170) is not available.
What is the SMILES notation for CID 178036170?
The canonical SMILES for CID 178036170 is FC(CCC[Si](Cl)Cl)c1ccccc1.
What is the InChIKey of CID 178036170?
The InChIKey is ZRGVFGHQECEEHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2FSi/c11-14(12)8-4-7-10(13)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2.
What are the key properties of CID 178036170?
CID 178036170 has a molecular weight of 250.20 g/mol, XLogP of 4.44, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 178036170 is sourced from PubChem (CID 178036170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).