CID 68817455

C17H33OSi — CID 68817455

IUPAC—
SMILESC[Si](C)O/C1=C/CCCC(C(C)(C)C)CCCCC1
InChIInChI=1S/C17H33OSi/c1-17(2,3)15-11-7-6-8-13-16(18-19(4)5)14-10-9-12-15/h14-15H,6-13H2,1-5H3/b16-14+
InChIKeySNWQEAFZMQBTIL-JQIJEIRASA-N
MW281.54 g/mol
LogP5.93
Rot. Bonds2

About CID 68817455

CID 68817455 (PubChem CID 68817455) has the molecular formula C17H33OSi and a molecular weight of 281.54 g/mol.

Molecular Properties

Compound NameCID 68817455
PubChem CID68817455
Molecular FormulaC17H33OSi
Molecular Weight281.54 g/mol
Exact Mass281.23
IUPAC Name—
SMILESC[Si](C)O/C1=C/CCCC(C(C)(C)C)CCCCC1
InChIInChI=1S/C17H33OSi/c1-17(2,3)15-11-7-6-8-13-16(18-19(4)5)14-10-9-12-15/h14-15H,6-13H2,1-5H3/b16-14+
InChIKeySNWQEAFZMQBTIL-JQIJEIRASA-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 68817455?
The IUPAC name of CID 68817455 (CID 68817455) is not available.
What is the SMILES notation for CID 68817455?
The canonical SMILES for CID 68817455 is C[Si](C)O/C1=C/CCCC(C(C)(C)C)CCCCC1.
What is the InChIKey of CID 68817455?
The InChIKey is SNWQEAFZMQBTIL-JQIJEIRASA-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/h14-15H,6-13H2,1-5H3/b16-14+.
What are the key properties of CID 68817455?
CID 68817455 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 68817455 is sourced from PubChem (CID 68817455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).