1,1,2-trimethyl-6-propa-1,2-dienylsilinane

C11H20Si — CID 174897712

IUPAC1,1,2-trimethyl-6-propa-1,2-dienylsilinane
SMILESC=C=CC1CCCC(C)[Si]1(C)C
InChIInChI=1S/C11H20Si/c1-5-7-11-9-6-8-10(2)12(11,3)4/h7,10-11H,1,6,8-9H2,2-4H3
InChIKeyZQLCNPLVCLRSDJ-UHFFFAOYSA-N
MW180.37 g/mol
LogP3.98
Rot. Bonds1

About 1,1,2-trimethyl-6-propa-1,2-dienylsilinane

1,1,2-trimethyl-6-propa-1,2-dienylsilinane (PubChem CID 174897712) has the molecular formula C11H20Si and a molecular weight of 180.37 g/mol. Its IUPAC name is 1,1,2-trimethyl-6-propa-1,2-dienylsilinane.

Molecular Properties

Compound Name1,1,2-trimethyl-6-propa-1,2-dienylsilinane
PubChem CID174897712
Molecular FormulaC11H20Si
Molecular Weight180.37 g/mol
Exact Mass180.13
IUPAC Name1,1,2-trimethyl-6-propa-1,2-dienylsilinane
SMILESC=C=CC1CCCC(C)[Si]1(C)C
InChIInChI=1S/C11H20Si/c1-5-7-11-9-6-8-10(2)12(11,3)4/h7,10-11H,1,6,8-9H2,2-4H3
InChIKeyZQLCNPLVCLRSDJ-UHFFFAOYSA-N
XLogP3.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.37
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,2-trimethyl-6-propa-1,2-dienylsilinane?
The IUPAC name of 1,1,2-trimethyl-6-propa-1,2-dienylsilinane (CID 174897712) is 1,1,2-trimethyl-6-propa-1,2-dienylsilinane.
What is the SMILES notation for 1,1,2-trimethyl-6-propa-1,2-dienylsilinane?
The canonical SMILES for 1,1,2-trimethyl-6-propa-1,2-dienylsilinane is C=C=CC1CCCC(C)[Si]1(C)C.
What is the InChIKey of 1,1,2-trimethyl-6-propa-1,2-dienylsilinane?
The InChIKey is ZQLCNPLVCLRSDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20Si/c1-5-7-11-9-6-8-10(2)12(11,3)4/h7,10-11H,1,6,8-9H2,2-4H3.
What are the key properties of 1,1,2-trimethyl-6-propa-1,2-dienylsilinane?
1,1,2-trimethyl-6-propa-1,2-dienylsilinane has a molecular weight of 180.37 g/mol, XLogP of 3.98, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2-trimethyl-6-propa-1,2-dienylsilinane is sourced from PubChem (CID 174897712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).