dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane

C18H32Si — CID 23266024

IUPACdimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane
SMILESC=CC(C)C/C=C/C[Si](C)(C)C/C=C/CC(C)C=C
InChIInChI=1S/C18H32Si/c1-7-17(3)13-9-11-15-19(5,6)16-12-10-14-18(4)8-2/h7-12,17-18H,1-2,13-16H2,3-6H3/b11-9+,12-10+
InChIKeyHPVJYZDWHFJQED-WGDLNXRISA-N
MW276.54 g/mol
LogP6.23
Rot. Bonds10

About dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane

dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane (PubChem CID 23266024) has the molecular formula C18H32Si and a molecular weight of 276.54 g/mol. Its IUPAC name is dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane.

Molecular Properties

Compound Namedimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane
PubChem CID23266024
Molecular FormulaC18H32Si
Molecular Weight276.54 g/mol
Exact Mass276.23
IUPAC Namedimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane
SMILESC=CC(C)C/C=C/C[Si](C)(C)C/C=C/CC(C)C=C
InChIInChI=1S/C18H32Si/c1-7-17(3)13-9-11-15-19(5,6)16-12-10-14-18(4)8-2/h7-12,17-18H,1-2,13-16H2,3-6H3/b11-9+,12-10+
InChIKeyHPVJYZDWHFJQED-WGDLNXRISA-N
XLogP6.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.54
LogP ≤ 56.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane?
The IUPAC name of dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane (CID 23266024) is dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane.
What is the SMILES notation for dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane?
The canonical SMILES for dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane is C=CC(C)C/C=C/C[Si](C)(C)C/C=C/CC(C)C=C.
What is the InChIKey of dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane?
The InChIKey is HPVJYZDWHFJQED-WGDLNXRISA-N. The full InChI is InChI=1S/C18H32Si/c1-7-17(3)13-9-11-15-19(5,6)16-12-10-14-18(4)8-2/h7-12,17-18H,1-2,13-16H2,3-6H3/b11-9+,12-10+.
What are the key properties of dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane?
dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane has a molecular weight of 276.54 g/mol, XLogP of 6.23, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis[(2E)-5-methylhepta-2,6-dienyl]silane is sourced from PubChem (CID 23266024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).