CID 162474759

C14H28O6Si — CID 162474759

IUPAC—
SMILESCCOC(CO[Si]CCCOCC1CO1)(OCC)OCC
InChIInChI=1S/C14H28O6Si/c1-4-17-14(18-5-2,19-6-3)12-20-21-9-7-8-15-10-13-11-16-13/h13H,4-12H2,1-3H3
InChIKeyHTSGYHPNMSAZPP-UHFFFAOYSA-N
MW320.46 g/mol
LogP1.61
Rot. Bonds15

About CID 162474759

CID 162474759 (PubChem CID 162474759) has the molecular formula C14H28O6Si and a molecular weight of 320.46 g/mol.

Molecular Properties

Compound NameCID 162474759
PubChem CID162474759
Molecular FormulaC14H28O6Si
Molecular Weight320.46 g/mol
Exact Mass320.17
IUPAC Name—
SMILESCCOC(CO[Si]CCCOCC1CO1)(OCC)OCC
InChIInChI=1S/C14H28O6Si/c1-4-17-14(18-5-2,19-6-3)12-20-21-9-7-8-15-10-13-11-16-13/h13H,4-12H2,1-3H3
InChIKeyHTSGYHPNMSAZPP-UHFFFAOYSA-N
XLogP1.61
TPSA58.68 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.46
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 162474759?
The IUPAC name of CID 162474759 (CID 162474759) is not available.
What is the SMILES notation for CID 162474759?
The canonical SMILES for CID 162474759 is CCOC(CO[Si]CCCOCC1CO1)(OCC)OCC.
What is the InChIKey of CID 162474759?
The InChIKey is HTSGYHPNMSAZPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O6Si/c1-4-17-14(18-5-2,19-6-3)12-20-21-9-7-8-15-10-13-11-16-13/h13H,4-12H2,1-3H3.
What are the key properties of CID 162474759?
CID 162474759 has a molecular weight of 320.46 g/mol, XLogP of 1.61, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 162474759 is sourced from PubChem (CID 162474759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).