CID 58309886

C4H8O2Si — CID 58309886

IUPAC—
SMILESC[C@]1(O)[Si][C@@]1(C)O
InChIInChI=1S/C4H8O2Si/c1-3(5)4(2,6)7-3/h5-6H,1-2H3/t3-,4+
InChIKeyMXGPYRKHBMKINH-ZXZARUISSA-N
MW116.19 g/mol
LogP-0.88
Rot. Bonds

About CID 58309886

CID 58309886 (PubChem CID 58309886) has the molecular formula C4H8O2Si and a molecular weight of 116.19 g/mol.

Molecular Properties

Compound NameCID 58309886
PubChem CID58309886
Molecular FormulaC4H8O2Si
Molecular Weight116.19 g/mol
Exact Mass116.03
IUPAC Name—
SMILESC[C@]1(O)[Si][C@@]1(C)O
InChIInChI=1S/C4H8O2Si/c1-3(5)4(2,6)7-3/h5-6H,1-2H3/t3-,4+
InChIKeyMXGPYRKHBMKINH-ZXZARUISSA-N
XLogP-0.88
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.19
LogP ≤ 5-0.88
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 CID 58309886?
The IUPAC name of CID 58309886 (CID 58309886) is not available.
What is the SMILES notation for CID 58309886?
The canonical SMILES for CID 58309886 is C[C@]1(O)[Si][C@@]1(C)O.
What is the InChIKey of CID 58309886?
The InChIKey is MXGPYRKHBMKINH-ZXZARUISSA-N. The full InChI is InChI=1S/C4H8O2Si/c1-3(5)4(2,6)7-3/h5-6H,1-2H3/t3-,4+.
What are the key properties of CID 58309886?
CID 58309886 has a molecular weight of 116.19 g/mol, XLogP of -0.88, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58309886 is sourced from PubChem (CID 58309886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).