2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane

C12H24O2Si — CID 14202584

IUPAC2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane
SMILESC[Si](C)(C)OCCOC1=CCCCCC1
InChIInChI=1S/C12H24O2Si/c1-15(2,3)14-11-10-13-12-8-6-4-5-7-9-12/h8H,4-7,9-11H2,1-3H3
InChIKeyBTCZOMHBHJJUQC-UHFFFAOYSA-N
MW228.41 g/mol
LogP3.70
Rot. Bonds5

About 2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane

2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane (PubChem CID 14202584) has the molecular formula C12H24O2Si and a molecular weight of 228.41 g/mol. Its IUPAC name is 2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane.

Molecular Properties

Compound Name2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane
PubChem CID14202584
Molecular FormulaC12H24O2Si
Molecular Weight228.41 g/mol
Exact Mass228.15
IUPAC Name2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane
SMILESC[Si](C)(C)OCCOC1=CCCCCC1
InChIInChI=1S/C12H24O2Si/c1-15(2,3)14-11-10-13-12-8-6-4-5-7-9-12/h8H,4-7,9-11H2,1-3H3
InChIKeyBTCZOMHBHJJUQC-UHFFFAOYSA-N
XLogP3.70
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.41
LogP ≤ 53.70
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 2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane?
The IUPAC name of 2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane (CID 14202584) is 2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane.
What is the SMILES notation for 2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane?
The canonical SMILES for 2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane is C[Si](C)(C)OCCOC1=CCCCCC1.
What is the InChIKey of 2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane?
The InChIKey is BTCZOMHBHJJUQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2Si/c1-15(2,3)14-11-10-13-12-8-6-4-5-7-9-12/h8H,4-7,9-11H2,1-3H3.
What are the key properties of 2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane?
2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane has a molecular weight of 228.41 g/mol, XLogP of 3.70, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohepten-1-yloxy)ethoxy-trimethylsilane is sourced from PubChem (CID 14202584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).