CID 22908386

C16H27OSi — CID 22908386

IUPAC—
SMILESC=CC(C)C1=CC(O[Si](C)C)(C(C)(C)C)CC1=C
InChIInChI=1S/C16H27OSi/c1-9-12(2)14-11-16(10-13(14)3,15(4,5)6)17-18(7)8/h9,11-12H,1,3,10H2,2,4-8H3
InChIKeyVAHKYFNGEIXYGV-UHFFFAOYSA-N
MW263.48 g/mol
LogP4.75
Rot. Bonds4

About CID 22908386

CID 22908386 (PubChem CID 22908386) has the molecular formula C16H27OSi and a molecular weight of 263.48 g/mol.

Molecular Properties

Compound NameCID 22908386
PubChem CID22908386
Molecular FormulaC16H27OSi
Molecular Weight263.48 g/mol
Exact Mass263.18
IUPAC Name—
SMILESC=CC(C)C1=CC(O[Si](C)C)(C(C)(C)C)CC1=C
InChIInChI=1S/C16H27OSi/c1-9-12(2)14-11-16(10-13(14)3,15(4,5)6)17-18(7)8/h9,11-12H,1,3,10H2,2,4-8H3
InChIKeyVAHKYFNGEIXYGV-UHFFFAOYSA-N
XLogP4.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.48
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 22908386?
The IUPAC name of CID 22908386 (CID 22908386) is not available.
What is the SMILES notation for CID 22908386?
The canonical SMILES for CID 22908386 is C=CC(C)C1=CC(O[Si](C)C)(C(C)(C)C)CC1=C.
What is the InChIKey of CID 22908386?
The InChIKey is VAHKYFNGEIXYGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27OSi/c1-9-12(2)14-11-16(10-13(14)3,15(4,5)6)17-18(7)8/h9,11-12H,1,3,10H2,2,4-8H3.
What are the key properties of CID 22908386?
CID 22908386 has a molecular weight of 263.48 g/mol, XLogP of 4.75, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22908386 is sourced from PubChem (CID 22908386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).