chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane

C8H16ClFSi — CID 102281589

IUPACchloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane
SMILESC=CCC(C)C[Si](C)(F)CCl
InChIInChI=1S/C8H16ClFSi/c1-4-5-8(2)6-11(3,10)7-9/h4,8H,1,5-7H2,2-3H3
InChIKeyOAVYDDMVAACFSL-UHFFFAOYSA-N
MW194.75 g/mol
LogP3.52
Rot. Bonds5

About chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane

chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane (PubChem CID 102281589) has the molecular formula C8H16ClFSi and a molecular weight of 194.75 g/mol. Its IUPAC name is chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane.

Molecular Properties

Compound Namechloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane
PubChem CID102281589
Molecular FormulaC8H16ClFSi
Molecular Weight194.75 g/mol
Exact Mass194.07
IUPAC Namechloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane
SMILESC=CCC(C)C[Si](C)(F)CCl
InChIInChI=1S/C8H16ClFSi/c1-4-5-8(2)6-11(3,10)7-9/h4,8H,1,5-7H2,2-3H3
InChIKeyOAVYDDMVAACFSL-UHFFFAOYSA-N
XLogP3.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.75
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', '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 chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane?
The IUPAC name of chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane (CID 102281589) is chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane.
What is the SMILES notation for chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane?
The canonical SMILES for chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane is C=CCC(C)C[Si](C)(F)CCl.
What is the InChIKey of chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane?
The InChIKey is OAVYDDMVAACFSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16ClFSi/c1-4-5-8(2)6-11(3,10)7-9/h4,8H,1,5-7H2,2-3H3.
What are the key properties of chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane?
chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane has a molecular weight of 194.75 g/mol, XLogP of 3.52, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethyl-fluoro-methyl-(2-methylpent-4-enyl)silane is sourced from PubChem (CID 102281589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).