CID 66989853

C14H13ClSi — CID 66989853

IUPAC—
SMILESCc1ccccc1C([Si]Cl)c1ccccc1
InChIInChI=1S/C14H13ClSi/c1-11-7-5-6-10-13(11)14(16-15)12-8-3-2-4-9-12/h2-10,14H,1H3
InChIKeyFKBCBHBHRMRBNH-UHFFFAOYSA-N
MW244.80 g/mol
LogP3.94
Rot. Bonds3

About CID 66989853

CID 66989853 (PubChem CID 66989853) has the molecular formula C14H13ClSi and a molecular weight of 244.80 g/mol.

Molecular Properties

Compound NameCID 66989853
PubChem CID66989853
Molecular FormulaC14H13ClSi
Molecular Weight244.80 g/mol
Exact Mass244.05
IUPAC Name—
SMILESCc1ccccc1C([Si]Cl)c1ccccc1
InChIInChI=1S/C14H13ClSi/c1-11-7-5-6-10-13(11)14(16-15)12-8-3-2-4-9-12/h2-10,14H,1H3
InChIKeyFKBCBHBHRMRBNH-UHFFFAOYSA-N
XLogP3.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.80
LogP ≤ 53.94
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 66989853?
The IUPAC name of CID 66989853 (CID 66989853) is not available.
What is the SMILES notation for CID 66989853?
The canonical SMILES for CID 66989853 is Cc1ccccc1C([Si]Cl)c1ccccc1.
What is the InChIKey of CID 66989853?
The InChIKey is FKBCBHBHRMRBNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClSi/c1-11-7-5-6-10-13(11)14(16-15)12-8-3-2-4-9-12/h2-10,14H,1H3.
What are the key properties of CID 66989853?
CID 66989853 has a molecular weight of 244.80 g/mol, XLogP of 3.94, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66989853 is sourced from PubChem (CID 66989853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).