CID 58814264

C4H8OSi — CID 58814264

IUPAC—
SMILESC[Si]CC1CO1
InChIInChI=1S/C4H8OSi/c1-6-3-4-2-5-4/h4H,2-3H2,1H3
InChIKeySSWCTPKTZRMEOG-UHFFFAOYSA-N
MW100.19 g/mol
LogP0.56
Rot. Bonds2

About CID 58814264

CID 58814264 (PubChem CID 58814264) has the molecular formula C4H8OSi and a molecular weight of 100.19 g/mol.

Molecular Properties

Compound NameCID 58814264
PubChem CID58814264
Molecular FormulaC4H8OSi
Molecular Weight100.19 g/mol
Exact Mass100.03
IUPAC Name—
SMILESC[Si]CC1CO1
InChIInChI=1S/C4H8OSi/c1-6-3-4-2-5-4/h4H,2-3H2,1H3
InChIKeySSWCTPKTZRMEOG-UHFFFAOYSA-N
XLogP0.56
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.19
LogP ≤ 50.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 58814264?
The IUPAC name of CID 58814264 (CID 58814264) is not available.
What is the SMILES notation for CID 58814264?
The canonical SMILES for CID 58814264 is C[Si]CC1CO1.
What is the InChIKey of CID 58814264?
The InChIKey is SSWCTPKTZRMEOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8OSi/c1-6-3-4-2-5-4/h4H,2-3H2,1H3.
What are the key properties of CID 58814264?
CID 58814264 has a molecular weight of 100.19 g/mol, XLogP of 0.56, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58814264 is sourced from PubChem (CID 58814264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).