[(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane

C16H32O3Si2 — CID 11163283

IUPAC[(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane
SMILESCCO/C(O[Si](C)(C)C)=C1/CCCCC=C1O[Si](C)(C)C
InChIInChI=1S/C16H32O3Si2/c1-8-17-16(19-21(5,6)7)14-12-10-9-11-13-15(14)18-20(2,3)4/h13H,8-12H2,1-7H3/b16-14+
InChIKeyOCPMIFDUZALREA-JQIJEIRASA-N
MW328.60 g/mol
LogP5.40
Rot. Bonds6

About [(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane

[(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane (PubChem CID 11163283) has the molecular formula C16H32O3Si2 and a molecular weight of 328.60 g/mol. Its IUPAC name is [(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane.

Molecular Properties

Compound Name[(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane
PubChem CID11163283
Molecular FormulaC16H32O3Si2
Molecular Weight328.60 g/mol
Exact Mass328.19
IUPAC Name[(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane
SMILESCCO/C(O[Si](C)(C)C)=C1/CCCCC=C1O[Si](C)(C)C
InChIInChI=1S/C16H32O3Si2/c1-8-17-16(19-21(5,6)7)14-12-10-9-11-13-15(14)18-20(2,3)4/h13H,8-12H2,1-7H3/b16-14+
InChIKeyOCPMIFDUZALREA-JQIJEIRASA-N
XLogP5.40
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.60
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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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Frequently Asked Questions

What is the IUPAC name of [(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane?
The IUPAC name of [(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane (CID 11163283) is [(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane.
What is the SMILES notation for [(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane?
The canonical SMILES for [(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane is CCO/C(O[Si](C)(C)C)=C1/CCCCC=C1O[Si](C)(C)C.
What is the InChIKey of [(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane?
The InChIKey is OCPMIFDUZALREA-JQIJEIRASA-N. The full InChI is InChI=1S/C16H32O3Si2/c1-8-17-16(19-21(5,6)7)14-12-10-9-11-13-15(14)18-20(2,3)4/h13H,8-12H2,1-7H3/b16-14+.
What are the key properties of [(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane?
[(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane has a molecular weight of 328.60 g/mol, XLogP of 5.40, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-ethoxy-(2-trimethylsilyloxycyclohept-2-en-1-ylidene)methoxy]-trimethylsilane is sourced from PubChem (CID 11163283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).