CID 155659061

C23H47O4Si2 — CID 155659061

IUPAC—
SMILESCCO[Si](OCC)C(C)(CC)C(=O)O[Si](C1CCCCC1)(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C23H47O4Si2/c1-11-23(10,28(25-12-2)26-13-3)20(24)27-29(21(4,5)6,22(7,8)9)19-17-15-14-16-18-19/h19H,11-18H2,1-10H3
InChIKeyWSMFWRYOSQXFFR-UHFFFAOYSA-N
MW443.80 g/mol
LogP7.14
Rot. Bonds9

About CID 155659061

CID 155659061 (PubChem CID 155659061) has the molecular formula C23H47O4Si2 and a molecular weight of 443.80 g/mol.

Molecular Properties

Compound NameCID 155659061
PubChem CID155659061
Molecular FormulaC23H47O4Si2
Molecular Weight443.80 g/mol
Exact Mass443.30
IUPAC Name—
SMILESCCO[Si](OCC)C(C)(CC)C(=O)O[Si](C1CCCCC1)(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C23H47O4Si2/c1-11-23(10,28(25-12-2)26-13-3)20(24)27-29(21(4,5)6,22(7,8)9)19-17-15-14-16-18-19/h19H,11-18H2,1-10H3
InChIKeyWSMFWRYOSQXFFR-UHFFFAOYSA-N
XLogP7.14
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.80
LogP ≤ 57.14
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 155659061?
The IUPAC name of CID 155659061 (CID 155659061) is not available.
What is the SMILES notation for CID 155659061?
The canonical SMILES for CID 155659061 is CCO[Si](OCC)C(C)(CC)C(=O)O[Si](C1CCCCC1)(C(C)(C)C)C(C)(C)C.
What is the InChIKey of CID 155659061?
The InChIKey is WSMFWRYOSQXFFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H47O4Si2/c1-11-23(10,28(25-12-2)26-13-3)20(24)27-29(21(4,5)6,22(7,8)9)19-17-15-14-16-18-19/h19H,11-18H2,1-10H3.
What are the key properties of CID 155659061?
CID 155659061 has a molecular weight of 443.80 g/mol, XLogP of 7.14, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155659061 is sourced from PubChem (CID 155659061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).