6-chlorohexa-1,2-dienyl(trimethyl)silane

C9H17ClSi — CID 102405277

IUPAC6-chlorohexa-1,2-dienyl(trimethyl)silane
SMILESC[Si](C)(C)C=C=CCCCCl
InChIInChI=1S/C9H17ClSi/c1-11(2,3)9-7-5-4-6-8-10/h5,9H,4,6,8H2,1-3H3
InChIKeyZRHPODYTJNNVNT-UHFFFAOYSA-N
MW188.77 g/mol
LogP3.59
Rot. Bonds4

About 6-chlorohexa-1,2-dienyl(trimethyl)silane

6-chlorohexa-1,2-dienyl(trimethyl)silane (PubChem CID 102405277) has the molecular formula C9H17ClSi and a molecular weight of 188.77 g/mol. Its IUPAC name is 6-chlorohexa-1,2-dienyl(trimethyl)silane.

Molecular Properties

Compound Name6-chlorohexa-1,2-dienyl(trimethyl)silane
PubChem CID102405277
Molecular FormulaC9H17ClSi
Molecular Weight188.77 g/mol
Exact Mass188.08
IUPAC Name6-chlorohexa-1,2-dienyl(trimethyl)silane
SMILESC[Si](C)(C)C=C=CCCCCl
InChIInChI=1S/C9H17ClSi/c1-11(2,3)9-7-5-4-6-8-10/h5,9H,4,6,8H2,1-3H3
InChIKeyZRHPODYTJNNVNT-UHFFFAOYSA-N
XLogP3.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.77
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-chlorohexa-1,2-dienyl(trimethyl)silane?
The IUPAC name of 6-chlorohexa-1,2-dienyl(trimethyl)silane (CID 102405277) is 6-chlorohexa-1,2-dienyl(trimethyl)silane.
What is the SMILES notation for 6-chlorohexa-1,2-dienyl(trimethyl)silane?
The canonical SMILES for 6-chlorohexa-1,2-dienyl(trimethyl)silane is C[Si](C)(C)C=C=CCCCCl.
What is the InChIKey of 6-chlorohexa-1,2-dienyl(trimethyl)silane?
The InChIKey is ZRHPODYTJNNVNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17ClSi/c1-11(2,3)9-7-5-4-6-8-10/h5,9H,4,6,8H2,1-3H3.
What are the key properties of 6-chlorohexa-1,2-dienyl(trimethyl)silane?
6-chlorohexa-1,2-dienyl(trimethyl)silane has a molecular weight of 188.77 g/mol, XLogP of 3.59, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chlorohexa-1,2-dienyl(trimethyl)silane is sourced from PubChem (CID 102405277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).