CID 156644261

C25H53OSi — CID 156644261

IUPAC—
SMILESCC[Si](CC)CCCOCC(CCC(C)CC(C)(C)C)C(C)CC(C)(C)C
InChIInChI=1S/C25H53OSi/c1-11-27(12-2)17-13-16-26-20-23(22(4)19-25(8,9)10)15-14-21(3)18-24(5,6)7/h21-23H,11-20H2,1-10H3
InChIKeyNUZVIDKEOJMVQO-UHFFFAOYSA-N
MW397.78 g/mol
LogP8.47
Rot. Bonds14

About CID 156644261

CID 156644261 (PubChem CID 156644261) has the molecular formula C25H53OSi and a molecular weight of 397.78 g/mol.

Molecular Properties

Compound NameCID 156644261
PubChem CID156644261
Molecular FormulaC25H53OSi
Molecular Weight397.78 g/mol
Exact Mass397.39
IUPAC Name—
SMILESCC[Si](CC)CCCOCC(CCC(C)CC(C)(C)C)C(C)CC(C)(C)C
InChIInChI=1S/C25H53OSi/c1-11-27(12-2)17-13-16-26-20-23(22(4)19-25(8,9)10)15-14-21(3)18-24(5,6)7/h21-23H,11-20H2,1-10H3
InChIKeyNUZVIDKEOJMVQO-UHFFFAOYSA-N
XLogP8.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.78
LogP ≤ 58.47
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 156644261?
The IUPAC name of CID 156644261 (CID 156644261) is not available.
What is the SMILES notation for CID 156644261?
The canonical SMILES for CID 156644261 is CC[Si](CC)CCCOCC(CCC(C)CC(C)(C)C)C(C)CC(C)(C)C.
What is the InChIKey of CID 156644261?
The InChIKey is NUZVIDKEOJMVQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H53OSi/c1-11-27(12-2)17-13-16-26-20-23(22(4)19-25(8,9)10)15-14-21(3)18-24(5,6)7/h21-23H,11-20H2,1-10H3.
What are the key properties of CID 156644261?
CID 156644261 has a molecular weight of 397.78 g/mol, XLogP of 8.47, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 156644261 is sourced from PubChem (CID 156644261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).