CID 67672299

C10H13Cl2Si — CID 67672299

IUPAC—
SMILESCc1ccccc1CC(C)[Si](Cl)Cl
InChIInChI=1S/C10H13Cl2Si/c1-8-5-3-4-6-10(8)7-9(2)13(11)12/h3-6,9H,7H2,1-2H3
InChIKeyLWYNKSDVNHTGSP-UHFFFAOYSA-N
MW232.21 g/mol
LogP3.89
Rot. Bonds3

About CID 67672299

CID 67672299 (PubChem CID 67672299) has the molecular formula C10H13Cl2Si and a molecular weight of 232.21 g/mol.

Molecular Properties

Compound NameCID 67672299
PubChem CID67672299
Molecular FormulaC10H13Cl2Si
Molecular Weight232.21 g/mol
Exact Mass231.02
IUPAC Name—
SMILESCc1ccccc1CC(C)[Si](Cl)Cl
InChIInChI=1S/C10H13Cl2Si/c1-8-5-3-4-6-10(8)7-9(2)13(11)12/h3-6,9H,7H2,1-2H3
InChIKeyLWYNKSDVNHTGSP-UHFFFAOYSA-N
XLogP3.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.21
LogP ≤ 53.89
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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Frequently Asked Questions

What is the IUPAC name of CID 67672299?
The IUPAC name of CID 67672299 (CID 67672299) is not available.
What is the SMILES notation for CID 67672299?
The canonical SMILES for CID 67672299 is Cc1ccccc1CC(C)[Si](Cl)Cl.
What is the InChIKey of CID 67672299?
The InChIKey is LWYNKSDVNHTGSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Cl2Si/c1-8-5-3-4-6-10(8)7-9(2)13(11)12/h3-6,9H,7H2,1-2H3.
What are the key properties of CID 67672299?
CID 67672299 has a molecular weight of 232.21 g/mol, XLogP of 3.89, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 67672299 is sourced from PubChem (CID 67672299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).