CID 174397132

C8H11Cl2Si — CID 174397132

IUPAC—
SMILESCCc1ccccc1[Si].Cl.Cl
InChIInChI=1S/C8H9Si.2ClH/c1-2-7-5-3-4-6-8(7)9;;/h3-6H,2H2,1H3;2*1H
InChIKeyKMIHXTSUORMICI-UHFFFAOYSA-N
MW206.17 g/mol
LogP1.89
Rot. Bonds1

About CID 174397132

CID 174397132 (PubChem CID 174397132) has the molecular formula C8H11Cl2Si and a molecular weight of 206.17 g/mol.

Molecular Properties

Compound NameCID 174397132
PubChem CID174397132
Molecular FormulaC8H11Cl2Si
Molecular Weight206.17 g/mol
Exact Mass205.00
IUPAC Name—
SMILESCCc1ccccc1[Si].Cl.Cl
InChIInChI=1S/C8H9Si.2ClH/c1-2-7-5-3-4-6-8(7)9;;/h3-6H,2H2,1H3;2*1H
InChIKeyKMIHXTSUORMICI-UHFFFAOYSA-N
XLogP1.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.17
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 174397132?
The IUPAC name of CID 174397132 (CID 174397132) is not available.
What is the SMILES notation for CID 174397132?
The canonical SMILES for CID 174397132 is CCc1ccccc1[Si].Cl.Cl.
What is the InChIKey of CID 174397132?
The InChIKey is KMIHXTSUORMICI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9Si.2ClH/c1-2-7-5-3-4-6-8(7)9;;/h3-6H,2H2,1H3;2*1H.
What are the key properties of CID 174397132?
CID 174397132 has a molecular weight of 206.17 g/mol, XLogP of 1.89, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174397132 is sourced from PubChem (CID 174397132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).