CID 155659170

C24H47O4Si2 — CID 155659170

IUPAC—
SMILESCCC[Si](OC(=O)C(C)(CC)[Si](OCC)OCC)(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C24H47O4Si2/c1-6-20-30(21-16-12-10-13-17-21,22-18-14-11-15-19-22)28-23(25)24(5,7-2)29(26-8-3)27-9-4/h21-22H,6-20H2,1-5H3
InChIKeyKALSTGWGMBMMQA-UHFFFAOYSA-N
MW455.81 g/mol
LogP7.29
Rot. Bonds12

About CID 155659170

CID 155659170 (PubChem CID 155659170) has the molecular formula C24H47O4Si2 and a molecular weight of 455.81 g/mol.

Molecular Properties

Compound NameCID 155659170
PubChem CID155659170
Molecular FormulaC24H47O4Si2
Molecular Weight455.81 g/mol
Exact Mass455.30
IUPAC Name—
SMILESCCC[Si](OC(=O)C(C)(CC)[Si](OCC)OCC)(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C24H47O4Si2/c1-6-20-30(21-16-12-10-13-17-21,22-18-14-11-15-19-22)28-23(25)24(5,7-2)29(26-8-3)27-9-4/h21-22H,6-20H2,1-5H3
InChIKeyKALSTGWGMBMMQA-UHFFFAOYSA-N
XLogP7.29
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500455.81
LogP ≤ 57.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 155659170?
The IUPAC name of CID 155659170 (CID 155659170) is not available.
What is the SMILES notation for CID 155659170?
The canonical SMILES for CID 155659170 is CCC[Si](OC(=O)C(C)(CC)[Si](OCC)OCC)(C1CCCCC1)C1CCCCC1.
What is the InChIKey of CID 155659170?
The InChIKey is KALSTGWGMBMMQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H47O4Si2/c1-6-20-30(21-16-12-10-13-17-21,22-18-14-11-15-19-22)28-23(25)24(5,7-2)29(26-8-3)27-9-4/h21-22H,6-20H2,1-5H3.
What are the key properties of CID 155659170?
CID 155659170 has a molecular weight of 455.81 g/mol, XLogP of 7.29, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155659170 is sourced from PubChem (CID 155659170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).