CID 58219179

C5H12OSSi — CID 58219179

IUPAC—
SMILESCCO[Si]CCSC
InChIInChI=1S/C5H12OSSi/c1-3-6-8-5-4-7-2/h3-5H2,1-2H3
InChIKeyUPNDNEGCANKYSV-UHFFFAOYSA-N
MW148.30 g/mol
LogP1.42
Rot. Bonds5

About CID 58219179

CID 58219179 (PubChem CID 58219179) has the molecular formula C5H12OSSi and a molecular weight of 148.30 g/mol.

Molecular Properties

Compound NameCID 58219179
PubChem CID58219179
Molecular FormulaC5H12OSSi
Molecular Weight148.30 g/mol
Exact Mass148.04
IUPAC Name—
SMILESCCO[Si]CCSC
InChIInChI=1S/C5H12OSSi/c1-3-6-8-5-4-7-2/h3-5H2,1-2H3
InChIKeyUPNDNEGCANKYSV-UHFFFAOYSA-N
XLogP1.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.30
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 58219179?
The IUPAC name of CID 58219179 (CID 58219179) is not available.
What is the SMILES notation for CID 58219179?
The canonical SMILES for CID 58219179 is CCO[Si]CCSC.
What is the InChIKey of CID 58219179?
The InChIKey is UPNDNEGCANKYSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12OSSi/c1-3-6-8-5-4-7-2/h3-5H2,1-2H3.
What are the key properties of CID 58219179?
CID 58219179 has a molecular weight of 148.30 g/mol, XLogP of 1.42, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58219179 is sourced from PubChem (CID 58219179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).