hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane

C16H32OSi — CID 11437113

IUPAChepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane
SMILESC=CCC(CC=C)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C16H32OSi/c1-9-11-16(12-10-2)17-18(13(3)4,14(5)6)15(7)8/h9-10,13-16H,1-2,11-12H2,3-8H3
InChIKeyQKPITMNJEVDPCS-UHFFFAOYSA-N
MW268.52 g/mol
LogP5.70
Rot. Bonds9

About hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane

hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane (PubChem CID 11437113) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Namehepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane
PubChem CID11437113
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Namehepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane
SMILESC=CCC(CC=C)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C16H32OSi/c1-9-11-16(12-10-2)17-18(13(3)4,14(5)6)15(7)8/h9-10,13-16H,1-2,11-12H2,3-8H3
InChIKeyQKPITMNJEVDPCS-UHFFFAOYSA-N
XLogP5.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.52
LogP ≤ 55.70
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'}

Analyze hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane?
The IUPAC name of hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane (CID 11437113) is hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane.
What is the SMILES notation for hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane?
The canonical SMILES for hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane is C=CCC(CC=C)O[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane?
The InChIKey is QKPITMNJEVDPCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32OSi/c1-9-11-16(12-10-2)17-18(13(3)4,14(5)6)15(7)8/h9-10,13-16H,1-2,11-12H2,3-8H3.
What are the key properties of hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane?
hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane has a molecular weight of 268.52 g/mol, XLogP of 5.70, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hepta-1,6-dien-4-yloxy-tri(propan-2-yl)silane is sourced from PubChem (CID 11437113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).