CID 11789967

C9H19O2Si — CID 11789967

IUPAC—
SMILESCO[Si](CC1CCCCC1)OC
InChIInChI=1S/C9H19O2Si/c1-10-12(11-2)8-9-6-4-3-5-7-9/h9H,3-8H2,1-2H3
InChIKeyJVOZXGZFXSVYJL-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.35
Rot. Bonds4

About CID 11789967

CID 11789967 (PubChem CID 11789967) has the molecular formula C9H19O2Si and a molecular weight of 187.33 g/mol.

Molecular Properties

Compound NameCID 11789967
PubChem CID11789967
Molecular FormulaC9H19O2Si
Molecular Weight187.33 g/mol
Exact Mass187.12
IUPAC Name—
SMILESCO[Si](CC1CCCCC1)OC
InChIInChI=1S/C9H19O2Si/c1-10-12(11-2)8-9-6-4-3-5-7-9/h9H,3-8H2,1-2H3
InChIKeyJVOZXGZFXSVYJL-UHFFFAOYSA-N
XLogP2.35
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 11789967?
The IUPAC name of CID 11789967 (CID 11789967) is not available.
What is the SMILES notation for CID 11789967?
The canonical SMILES for CID 11789967 is CO[Si](CC1CCCCC1)OC.
What is the InChIKey of CID 11789967?
The InChIKey is JVOZXGZFXSVYJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19O2Si/c1-10-12(11-2)8-9-6-4-3-5-7-9/h9H,3-8H2,1-2H3.
What are the key properties of CID 11789967?
CID 11789967 has a molecular weight of 187.33 g/mol, XLogP of 2.35, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11789967 is sourced from PubChem (CID 11789967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).