CID 18427000

C20H42OSi — CID 18427000

IUPAC
SMILESCCCCCCCCCCCCCCCCCC[Si]OCC
InChIInChI=1S/C20H42OSi/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-21-4-2/h3-20H2,1-2H3
InChIKeyRSPGJODRFLIJBR-UHFFFAOYSA-N
MW326.64 g/mol
LogP7.32
Rot. Bonds19

About CID 18427000

CID 18427000 (PubChem CID 18427000) has the molecular formula C20H42OSi and a molecular weight of 326.64 g/mol.

Molecular Properties

Compound NameCID 18427000
PubChem CID18427000
Molecular FormulaC20H42OSi
Molecular Weight326.64 g/mol
Exact Mass326.30
IUPAC Name
SMILESCCCCCCCCCCCCCCCCCC[Si]OCC
InChIInChI=1S/C20H42OSi/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-21-4-2/h3-20H2,1-2H3
InChIKeyRSPGJODRFLIJBR-UHFFFAOYSA-N
XLogP7.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds19
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.64
LogP ≤ 57.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 18427000?
The IUPAC name of CID 18427000 (CID 18427000) is not available.
What is the SMILES notation for CID 18427000?
The canonical SMILES for CID 18427000 is CCCCCCCCCCCCCCCCCC[Si]OCC.
What is the InChIKey of CID 18427000?
The InChIKey is RSPGJODRFLIJBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42OSi/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-21-4-2/h3-20H2,1-2H3.
What are the key properties of CID 18427000?
CID 18427000 has a molecular weight of 326.64 g/mol, XLogP of 7.32, 19 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18427000 is sourced from PubChem (CID 18427000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).