CID 136744211

C8H13SSi2 — CID 136744211

IUPAC
SMILESC[Si](C)(CC[Si])c1cccs1
InChIInChI=1S/C8H13SSi2/c1-11(2,7-6-10)8-4-3-5-9-8/h3-5H,6-7H2,1-2H3
InChIKeyXCQZHCQYXCOANT-UHFFFAOYSA-N
MW197.43 g/mol
LogP2.25
Rot. Bonds3

About CID 136744211

CID 136744211 (PubChem CID 136744211) has the molecular formula C8H13SSi2 and a molecular weight of 197.43 g/mol.

Molecular Properties

Compound NameCID 136744211
PubChem CID136744211
Molecular FormulaC8H13SSi2
Molecular Weight197.43 g/mol
Exact Mass197.03
IUPAC Name
SMILESC[Si](C)(CC[Si])c1cccs1
InChIInChI=1S/C8H13SSi2/c1-11(2,7-6-10)8-4-3-5-9-8/h3-5H,6-7H2,1-2H3
InChIKeyXCQZHCQYXCOANT-UHFFFAOYSA-N
XLogP2.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.43
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 136744211?
The IUPAC name of CID 136744211 (CID 136744211) is not available.
What is the SMILES notation for CID 136744211?
The canonical SMILES for CID 136744211 is C[Si](C)(CC[Si])c1cccs1.
What is the InChIKey of CID 136744211?
The InChIKey is XCQZHCQYXCOANT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13SSi2/c1-11(2,7-6-10)8-4-3-5-9-8/h3-5H,6-7H2,1-2H3.
What are the key properties of CID 136744211?
CID 136744211 has a molecular weight of 197.43 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136744211 is sourced from PubChem (CID 136744211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).