3-(cyclohepten-1-yloxy)propoxy-trimethylsilane

C13H26O2Si — CID 14202590

IUPAC3-(cyclohepten-1-yloxy)propoxy-trimethylsilane
SMILESC[Si](C)(C)OCCCOC1=CCCCCC1
InChIInChI=1S/C13H26O2Si/c1-16(2,3)15-12-8-11-14-13-9-6-4-5-7-10-13/h9H,4-8,10-12H2,1-3H3
InChIKeyYQOISCYBFASINK-UHFFFAOYSA-N
MW242.43 g/mol
LogP4.09
Rot. Bonds6

About 3-(cyclohepten-1-yloxy)propoxy-trimethylsilane

3-(cyclohepten-1-yloxy)propoxy-trimethylsilane (PubChem CID 14202590) has the molecular formula C13H26O2Si and a molecular weight of 242.43 g/mol. Its IUPAC name is 3-(cyclohepten-1-yloxy)propoxy-trimethylsilane.

Molecular Properties

Compound Name3-(cyclohepten-1-yloxy)propoxy-trimethylsilane
PubChem CID14202590
Molecular FormulaC13H26O2Si
Molecular Weight242.43 g/mol
Exact Mass242.17
IUPAC Name3-(cyclohepten-1-yloxy)propoxy-trimethylsilane
SMILESC[Si](C)(C)OCCCOC1=CCCCCC1
InChIInChI=1S/C13H26O2Si/c1-16(2,3)15-12-8-11-14-13-9-6-4-5-7-10-13/h9H,4-8,10-12H2,1-3H3
InChIKeyYQOISCYBFASINK-UHFFFAOYSA-N
XLogP4.09
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.43
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 3-(cyclohepten-1-yloxy)propoxy-trimethylsilane?
The IUPAC name of 3-(cyclohepten-1-yloxy)propoxy-trimethylsilane (CID 14202590) is 3-(cyclohepten-1-yloxy)propoxy-trimethylsilane.
What is the SMILES notation for 3-(cyclohepten-1-yloxy)propoxy-trimethylsilane?
The canonical SMILES for 3-(cyclohepten-1-yloxy)propoxy-trimethylsilane is C[Si](C)(C)OCCCOC1=CCCCCC1.
What is the InChIKey of 3-(cyclohepten-1-yloxy)propoxy-trimethylsilane?
The InChIKey is YQOISCYBFASINK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O2Si/c1-16(2,3)15-12-8-11-14-13-9-6-4-5-7-10-13/h9H,4-8,10-12H2,1-3H3.
What are the key properties of 3-(cyclohepten-1-yloxy)propoxy-trimethylsilane?
3-(cyclohepten-1-yloxy)propoxy-trimethylsilane has a molecular weight of 242.43 g/mol, XLogP of 4.09, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohepten-1-yloxy)propoxy-trimethylsilane is sourced from PubChem (CID 14202590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).