CID 68817086

C17H33OSi — CID 68817086

IUPAC—
SMILESC[Si](C)O/C1=C/CCCCC(C(C)(C)C)CCCC1
InChIInChI=1S/C17H33OSi/c1-17(2,3)15-11-7-6-8-13-16(18-19(4)5)14-10-9-12-15/h13,15H,6-12,14H2,1-5H3/b16-13+
InChIKeyXMKKWYGRAGNPRQ-DTQAZKPQSA-N
MW281.54 g/mol
LogP5.93
Rot. Bonds2

About CID 68817086

CID 68817086 (PubChem CID 68817086) has the molecular formula C17H33OSi and a molecular weight of 281.54 g/mol.

Molecular Properties

Compound NameCID 68817086
PubChem CID68817086
Molecular FormulaC17H33OSi
Molecular Weight281.54 g/mol
Exact Mass281.23
IUPAC Name—
SMILESC[Si](C)O/C1=C/CCCCC(C(C)(C)C)CCCC1
InChIInChI=1S/C17H33OSi/c1-17(2,3)15-11-7-6-8-13-16(18-19(4)5)14-10-9-12-15/h13,15H,6-12,14H2,1-5H3/b16-13+
InChIKeyXMKKWYGRAGNPRQ-DTQAZKPQSA-N
XLogP5.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.54
LogP ≤ 55.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 68817086?
The IUPAC name of CID 68817086 (CID 68817086) is not available.
What is the SMILES notation for CID 68817086?
The canonical SMILES for CID 68817086 is C[Si](C)O/C1=C/CCCCC(C(C)(C)C)CCCC1.
What is the InChIKey of CID 68817086?
The InChIKey is XMKKWYGRAGNPRQ-DTQAZKPQSA-N. The full InChI is InChI=1S/C17H33OSi/c1-17(2,3)15-11-7-6-8-13-16(18-19(4)5)14-10-9-12-15/h13,15H,6-12,14H2,1-5H3/b16-13+.
What are the key properties of CID 68817086?
CID 68817086 has a molecular weight of 281.54 g/mol, XLogP of 5.93, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 68817086 is sourced from PubChem (CID 68817086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).