hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane

C11H22Si — CID 123765176

IUPAChexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane
SMILESCC=C=C(CC)[Si](C)(C)C(C)C
InChIInChI=1S/C11H22Si/c1-7-9-11(8-2)12(5,6)10(3)4/h7,10H,8H2,1-6H3
InChIKeyIXFARXGAXLWRPQ-UHFFFAOYSA-N
MW182.38 g/mol
LogP4.16
Rot. Bonds3

About hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane

hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane (PubChem CID 123765176) has the molecular formula C11H22Si and a molecular weight of 182.38 g/mol. Its IUPAC name is hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane.

Molecular Properties

Compound Namehexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane
PubChem CID123765176
Molecular FormulaC11H22Si
Molecular Weight182.38 g/mol
Exact Mass182.15
IUPAC Namehexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane
SMILESCC=C=C(CC)[Si](C)(C)C(C)C
InChIInChI=1S/C11H22Si/c1-7-9-11(8-2)12(5,6)10(3)4/h7,10H,8H2,1-6H3
InChIKeyIXFARXGAXLWRPQ-UHFFFAOYSA-N
XLogP4.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.38
LogP ≤ 54.16
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 hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane?
The IUPAC name of hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane (CID 123765176) is hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane.
What is the SMILES notation for hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane?
The canonical SMILES for hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane is CC=C=C(CC)[Si](C)(C)C(C)C.
What is the InChIKey of hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane?
The InChIKey is IXFARXGAXLWRPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22Si/c1-7-9-11(8-2)12(5,6)10(3)4/h7,10H,8H2,1-6H3.
What are the key properties of hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane?
hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane has a molecular weight of 182.38 g/mol, XLogP of 4.16, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexa-3,4-dien-3-yl-dimethyl-propan-2-ylsilane is sourced from PubChem (CID 123765176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).