CID 155629589

C9H21Cl2OSi3 — CID 155629589

IUPAC—
SMILESC=C[Si](C)(CCC[Si](Cl)Cl)O[Si](C)(C)C
InChIInChI=1S/C9H21Cl2OSi3/c1-6-15(5,12-14(2,3)4)9-7-8-13(10)11/h6H,1,7-9H2,2-5H3
InChIKeyLYFUEOGDDBCMOQ-UHFFFAOYSA-N
MW300.43 g/mol
LogP4.49
Rot. Bonds7

About CID 155629589

CID 155629589 (PubChem CID 155629589) has the molecular formula C9H21Cl2OSi3 and a molecular weight of 300.43 g/mol.

Molecular Properties

Compound NameCID 155629589
PubChem CID155629589
Molecular FormulaC9H21Cl2OSi3
Molecular Weight300.43 g/mol
Exact Mass299.03
IUPAC Name—
SMILESC=C[Si](C)(CCC[Si](Cl)Cl)O[Si](C)(C)C
InChIInChI=1S/C9H21Cl2OSi3/c1-6-15(5,12-14(2,3)4)9-7-8-13(10)11/h6H,1,7-9H2,2-5H3
InChIKeyLYFUEOGDDBCMOQ-UHFFFAOYSA-N
XLogP4.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.43
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze CID 155629589 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 155629589?
The IUPAC name of CID 155629589 (CID 155629589) is not available.
What is the SMILES notation for CID 155629589?
The canonical SMILES for CID 155629589 is C=C[Si](C)(CCC[Si](Cl)Cl)O[Si](C)(C)C.
What is the InChIKey of CID 155629589?
The InChIKey is LYFUEOGDDBCMOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21Cl2OSi3/c1-6-15(5,12-14(2,3)4)9-7-8-13(10)11/h6H,1,7-9H2,2-5H3.
What are the key properties of CID 155629589?
CID 155629589 has a molecular weight of 300.43 g/mol, XLogP of 4.49, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155629589 is sourced from PubChem (CID 155629589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).