dichloro-hept-5-enyl-methylsilane

C8H16Cl2Si — CID 150059811

IUPACdichloro-hept-5-enyl-methylsilane
SMILESCC=CCCCC[Si](C)(Cl)Cl
InChIInChI=1S/C8H16Cl2Si/c1-3-4-5-6-7-8-11(2,9)10/h3-4H,5-8H2,1-2H3
InChIKeyDNBBATGGVHRQBF-UHFFFAOYSA-N
MW211.21 g/mol
LogP4.28
Rot. Bonds5

About dichloro-hept-5-enyl-methylsilane

dichloro-hept-5-enyl-methylsilane (PubChem CID 150059811) has the molecular formula C8H16Cl2Si and a molecular weight of 211.21 g/mol. Its IUPAC name is dichloro-hept-5-enyl-methylsilane.

Molecular Properties

Compound Namedichloro-hept-5-enyl-methylsilane
PubChem CID150059811
Molecular FormulaC8H16Cl2Si
Molecular Weight211.21 g/mol
Exact Mass210.04
IUPAC Namedichloro-hept-5-enyl-methylsilane
SMILESCC=CCCCC[Si](C)(Cl)Cl
InChIInChI=1S/C8H16Cl2Si/c1-3-4-5-6-7-8-11(2,9)10/h3-4H,5-8H2,1-2H3
InChIKeyDNBBATGGVHRQBF-UHFFFAOYSA-N
XLogP4.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.21
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloro-hept-5-enyl-methylsilane?
The IUPAC name of dichloro-hept-5-enyl-methylsilane (CID 150059811) is dichloro-hept-5-enyl-methylsilane.
What is the SMILES notation for dichloro-hept-5-enyl-methylsilane?
The canonical SMILES for dichloro-hept-5-enyl-methylsilane is CC=CCCCC[Si](C)(Cl)Cl.
What is the InChIKey of dichloro-hept-5-enyl-methylsilane?
The InChIKey is DNBBATGGVHRQBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16Cl2Si/c1-3-4-5-6-7-8-11(2,9)10/h3-4H,5-8H2,1-2H3.
What are the key properties of dichloro-hept-5-enyl-methylsilane?
dichloro-hept-5-enyl-methylsilane has a molecular weight of 211.21 g/mol, XLogP of 4.28, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-hept-5-enyl-methylsilane is sourced from PubChem (CID 150059811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).