CID 19860024

C8H17O3Si — CID 19860024

IUPAC—
SMILESCOC([Si])(OC)OCCC(C)C
InChIInChI=1S/C8H17O3Si/c1-7(2)5-6-11-8(12,9-3)10-4/h7H,5-6H2,1-4H3
InChIKeyRTEALZHEJRYLEC-UHFFFAOYSA-N
MW189.31 g/mol
LogP1.12
Rot. Bonds6

About CID 19860024

CID 19860024 (PubChem CID 19860024) has the molecular formula C8H17O3Si and a molecular weight of 189.31 g/mol.

Molecular Properties

Compound NameCID 19860024
PubChem CID19860024
Molecular FormulaC8H17O3Si
Molecular Weight189.31 g/mol
Exact Mass189.09
IUPAC Name—
SMILESCOC([Si])(OC)OCCC(C)C
InChIInChI=1S/C8H17O3Si/c1-7(2)5-6-11-8(12,9-3)10-4/h7H,5-6H2,1-4H3
InChIKeyRTEALZHEJRYLEC-UHFFFAOYSA-N
XLogP1.12
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.31
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 19860024?
The IUPAC name of CID 19860024 (CID 19860024) is not available.
What is the SMILES notation for CID 19860024?
The canonical SMILES for CID 19860024 is COC([Si])(OC)OCCC(C)C.
What is the InChIKey of CID 19860024?
The InChIKey is RTEALZHEJRYLEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17O3Si/c1-7(2)5-6-11-8(12,9-3)10-4/h7H,5-6H2,1-4H3.
What are the key properties of CID 19860024?
CID 19860024 has a molecular weight of 189.31 g/mol, XLogP of 1.12, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 19860024 is sourced from PubChem (CID 19860024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).