CID 68758374

C15H29O2Si — CID 68758374

IUPAC—
SMILESCCCC[Si](OCC)OC(C)=CC1CCCCC1
InChIInChI=1S/C15H29O2Si/c1-4-6-12-18(16-5-2)17-14(3)13-15-10-8-7-9-11-15/h13,15H,4-12H2,1-3H3
InChIKeyYVBPZOTZJYKYOR-UHFFFAOYSA-N
MW269.48 g/mol
LogP4.81
Rot. Bonds8

About CID 68758374

CID 68758374 (PubChem CID 68758374) has the molecular formula C15H29O2Si and a molecular weight of 269.48 g/mol.

Molecular Properties

Compound NameCID 68758374
PubChem CID68758374
Molecular FormulaC15H29O2Si
Molecular Weight269.48 g/mol
Exact Mass269.19
IUPAC Name—
SMILESCCCC[Si](OCC)OC(C)=CC1CCCCC1
InChIInChI=1S/C15H29O2Si/c1-4-6-12-18(16-5-2)17-14(3)13-15-10-8-7-9-11-15/h13,15H,4-12H2,1-3H3
InChIKeyYVBPZOTZJYKYOR-UHFFFAOYSA-N
XLogP4.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.48
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 68758374?
The IUPAC name of CID 68758374 (CID 68758374) is not available.
What is the SMILES notation for CID 68758374?
The canonical SMILES for CID 68758374 is CCCC[Si](OCC)OC(C)=CC1CCCCC1.
What is the InChIKey of CID 68758374?
The InChIKey is YVBPZOTZJYKYOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29O2Si/c1-4-6-12-18(16-5-2)17-14(3)13-15-10-8-7-9-11-15/h13,15H,4-12H2,1-3H3.
What are the key properties of CID 68758374?
CID 68758374 has a molecular weight of 269.48 g/mol, XLogP of 4.81, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 68758374 is sourced from PubChem (CID 68758374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).