2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane

C13H24OSi — CID 54518189

IUPAC2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane
SMILESC=CC(=CO[Si](C)(C)C)C1CCCCC1
InChIInChI=1S/C13H24OSi/c1-5-12(11-14-15(2,3)4)13-9-7-6-8-10-13/h5,11,13H,1,6-10H2,2-4H3
InChIKeyYNWPCEGCSVPFEH-UHFFFAOYSA-N
MW224.42 g/mol
LogP4.49
Rot. Bonds4

About 2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane

2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane (PubChem CID 54518189) has the molecular formula C13H24OSi and a molecular weight of 224.42 g/mol. Its IUPAC name is 2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane.

Molecular Properties

Compound Name2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane
PubChem CID54518189
Molecular FormulaC13H24OSi
Molecular Weight224.42 g/mol
Exact Mass224.16
IUPAC Name2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane
SMILESC=CC(=CO[Si](C)(C)C)C1CCCCC1
InChIInChI=1S/C13H24OSi/c1-5-12(11-14-15(2,3)4)13-9-7-6-8-10-13/h5,11,13H,1,6-10H2,2-4H3
InChIKeyYNWPCEGCSVPFEH-UHFFFAOYSA-N
XLogP4.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.42
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane?
The IUPAC name of 2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane (CID 54518189) is 2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane.
What is the SMILES notation for 2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane?
The canonical SMILES for 2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane is C=CC(=CO[Si](C)(C)C)C1CCCCC1.
What is the InChIKey of 2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane?
The InChIKey is YNWPCEGCSVPFEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24OSi/c1-5-12(11-14-15(2,3)4)13-9-7-6-8-10-13/h5,11,13H,1,6-10H2,2-4H3.
What are the key properties of 2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane?
2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane has a molecular weight of 224.42 g/mol, XLogP of 4.49, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylbuta-1,3-dienoxy(trimethyl)silane is sourced from PubChem (CID 54518189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).