1-hydroxysilin-2-ol

C5H6O2Si — CID 139646215

IUPAC1-hydroxysilin-2-ol
SMILESOc1cccc[si]1O
InChIInChI=1S/C5H6O2Si/c6-5-3-1-2-4-8(5)7/h1-4,6-7H
InChIKeyHIGFVHJNXROLEM-UHFFFAOYSA-N
MW126.19 g/mol
LogP0.17
Rot. Bonds

About 1-hydroxysilin-2-ol

1-hydroxysilin-2-ol (PubChem CID 139646215) has the molecular formula C5H6O2Si and a molecular weight of 126.19 g/mol. Its IUPAC name is 1-hydroxysilin-2-ol.

Molecular Properties

Compound Name1-hydroxysilin-2-ol
PubChem CID139646215
Molecular FormulaC5H6O2Si
Molecular Weight126.19 g/mol
Exact Mass126.01
IUPAC Name1-hydroxysilin-2-ol
SMILESOc1cccc[si]1O
InChIInChI=1S/C5H6O2Si/c6-5-3-1-2-4-8(5)7/h1-4,6-7H
InChIKeyHIGFVHJNXROLEM-UHFFFAOYSA-N
XLogP0.17
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.19
LogP ≤ 50.17
H-Bond Donors ≤ 52
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 1-hydroxysilin-2-ol?
The IUPAC name of 1-hydroxysilin-2-ol (CID 139646215) is 1-hydroxysilin-2-ol.
What is the SMILES notation for 1-hydroxysilin-2-ol?
The canonical SMILES for 1-hydroxysilin-2-ol is Oc1cccc[si]1O.
What is the InChIKey of 1-hydroxysilin-2-ol?
The InChIKey is HIGFVHJNXROLEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6O2Si/c6-5-3-1-2-4-8(5)7/h1-4,6-7H.
What are the key properties of 1-hydroxysilin-2-ol?
1-hydroxysilin-2-ol has a molecular weight of 126.19 g/mol, XLogP of 0.17, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxysilin-2-ol is sourced from PubChem (CID 139646215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).