8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane

C16H30OSi — CID 87079683

IUPAC8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane
SMILESCO[Si](C)(C)CCCCCCCCC1=CCC=C1
InChIInChI=1S/C16H30OSi/c1-17-18(2,3)15-11-7-5-4-6-8-12-16-13-9-10-14-16/h9,13-14H,4-8,10-12,15H2,1-3H3
InChIKeyBTINXXMIODUACD-UHFFFAOYSA-N
MW266.50 g/mol
LogP5.45
Rot. Bonds10

About 8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane

8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane (PubChem CID 87079683) has the molecular formula C16H30OSi and a molecular weight of 266.50 g/mol. Its IUPAC name is 8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane.

Molecular Properties

Compound Name8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane
PubChem CID87079683
Molecular FormulaC16H30OSi
Molecular Weight266.50 g/mol
Exact Mass266.21
IUPAC Name8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane
SMILESCO[Si](C)(C)CCCCCCCCC1=CCC=C1
InChIInChI=1S/C16H30OSi/c1-17-18(2,3)15-11-7-5-4-6-8-12-16-13-9-10-14-16/h9,13-14H,4-8,10-12,15H2,1-3H3
InChIKeyBTINXXMIODUACD-UHFFFAOYSA-N
XLogP5.45
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.50
LogP ≤ 55.45
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 8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane?
The IUPAC name of 8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane (CID 87079683) is 8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane.
What is the SMILES notation for 8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane?
The canonical SMILES for 8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane is CO[Si](C)(C)CCCCCCCCC1=CCC=C1.
What is the InChIKey of 8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane?
The InChIKey is BTINXXMIODUACD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30OSi/c1-17-18(2,3)15-11-7-5-4-6-8-12-16-13-9-10-14-16/h9,13-14H,4-8,10-12,15H2,1-3H3.
What are the key properties of 8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane?
8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane has a molecular weight of 266.50 g/mol, XLogP of 5.45, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclopenta-1,4-dien-1-yloctyl-methoxy-dimethylsilane is sourced from PubChem (CID 87079683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).