4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane

C17H32OSi — CID 70292486

IUPAC4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane
SMILESC=CC(CC=C[Si](C)(C)C(C)C)OC1CCCCC1
InChIInChI=1S/C17H32OSi/c1-6-16(18-17-11-8-7-9-12-17)13-10-14-19(4,5)15(2)3/h6,10,14-17H,1,7-9,11-13H2,2-5H3
InChIKeyGIDJWMHSVNFALH-UHFFFAOYSA-N
MW280.53 g/mol
LogP5.49
Rot. Bonds7

About 4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane

4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane (PubChem CID 70292486) has the molecular formula C17H32OSi and a molecular weight of 280.53 g/mol. Its IUPAC name is 4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane.

Molecular Properties

Compound Name4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane
PubChem CID70292486
Molecular FormulaC17H32OSi
Molecular Weight280.53 g/mol
Exact Mass280.22
IUPAC Name4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane
SMILESC=CC(CC=C[Si](C)(C)C(C)C)OC1CCCCC1
InChIInChI=1S/C17H32OSi/c1-6-16(18-17-11-8-7-9-12-17)13-10-14-19(4,5)15(2)3/h6,10,14-17H,1,7-9,11-13H2,2-5H3
InChIKeyGIDJWMHSVNFALH-UHFFFAOYSA-N
XLogP5.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.53
LogP ≤ 55.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane?
The IUPAC name of 4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane (CID 70292486) is 4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane.
What is the SMILES notation for 4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane?
The canonical SMILES for 4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane is C=CC(CC=C[Si](C)(C)C(C)C)OC1CCCCC1.
What is the InChIKey of 4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane?
The InChIKey is GIDJWMHSVNFALH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32OSi/c1-6-16(18-17-11-8-7-9-12-17)13-10-14-19(4,5)15(2)3/h6,10,14-17H,1,7-9,11-13H2,2-5H3.
What are the key properties of 4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane?
4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane has a molecular weight of 280.53 g/mol, XLogP of 5.49, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyloxyhexa-1,5-dienyl-dimethyl-propan-2-ylsilane is sourced from PubChem (CID 70292486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).