CID 158027119

C9H15O3Si2 — CID 158027119

IUPAC
SMILESCO[SiH](OC)OC.[Si]c1ccccc1
InChIInChI=1S/C6H5Si.C3H10O3Si/c7-6-4-2-1-3-5-6;1-4-7(5-2)6-3/h1-5H;7H,1-3H3
InChIKeyFGSSAYUFUBNZSW-UHFFFAOYSA-N
MW227.39 g/mol
LogP0.12
Rot. Bonds3

About CID 158027119

CID 158027119 (PubChem CID 158027119) has the molecular formula C9H15O3Si2 and a molecular weight of 227.39 g/mol.

Molecular Properties

Compound NameCID 158027119
PubChem CID158027119
Molecular FormulaC9H15O3Si2
Molecular Weight227.39 g/mol
Exact Mass227.06
IUPAC Name
SMILESCO[SiH](OC)OC.[Si]c1ccccc1
InChIInChI=1S/C6H5Si.C3H10O3Si/c7-6-4-2-1-3-5-6;1-4-7(5-2)6-3/h1-5H;7H,1-3H3
InChIKeyFGSSAYUFUBNZSW-UHFFFAOYSA-N
XLogP0.12
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 50.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 158027119?
The IUPAC name of CID 158027119 (CID 158027119) is not available.
What is the SMILES notation for CID 158027119?
The canonical SMILES for CID 158027119 is CO[SiH](OC)OC.[Si]c1ccccc1.
What is the InChIKey of CID 158027119?
The InChIKey is FGSSAYUFUBNZSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Si.C3H10O3Si/c7-6-4-2-1-3-5-6;1-4-7(5-2)6-3/h1-5H;7H,1-3H3.
What are the key properties of CID 158027119?
CID 158027119 has a molecular weight of 227.39 g/mol, XLogP of 0.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 158027119 is sourced from PubChem (CID 158027119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).