difluoro-methyl-(3-methylbut-2-enyl)silane

C6H12F2Si — CID 139667635

IUPACdifluoro-methyl-(3-methylbut-2-enyl)silane
SMILESCC(C)=CC[Si](C)(F)F
InChIInChI=1S/C6H12F2Si/c1-6(2)4-5-9(3,7)8/h4H,5H2,1-3H3
InChIKeyZADDYYXKASOQNU-UHFFFAOYSA-N
MW150.24 g/mol
LogP2.96
Rot. Bonds2

About difluoro-methyl-(3-methylbut-2-enyl)silane

difluoro-methyl-(3-methylbut-2-enyl)silane (PubChem CID 139667635) has the molecular formula C6H12F2Si and a molecular weight of 150.24 g/mol. Its IUPAC name is difluoro-methyl-(3-methylbut-2-enyl)silane.

Molecular Properties

Compound Namedifluoro-methyl-(3-methylbut-2-enyl)silane
PubChem CID139667635
Molecular FormulaC6H12F2Si
Molecular Weight150.24 g/mol
Exact Mass150.07
IUPAC Namedifluoro-methyl-(3-methylbut-2-enyl)silane
SMILESCC(C)=CC[Si](C)(F)F
InChIInChI=1S/C6H12F2Si/c1-6(2)4-5-9(3,7)8/h4H,5H2,1-3H3
InChIKeyZADDYYXKASOQNU-UHFFFAOYSA-N
XLogP2.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.24
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'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 difluoro-methyl-(3-methylbut-2-enyl)silane?
The IUPAC name of difluoro-methyl-(3-methylbut-2-enyl)silane (CID 139667635) is difluoro-methyl-(3-methylbut-2-enyl)silane.
What is the SMILES notation for difluoro-methyl-(3-methylbut-2-enyl)silane?
The canonical SMILES for difluoro-methyl-(3-methylbut-2-enyl)silane is CC(C)=CC[Si](C)(F)F.
What is the InChIKey of difluoro-methyl-(3-methylbut-2-enyl)silane?
The InChIKey is ZADDYYXKASOQNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12F2Si/c1-6(2)4-5-9(3,7)8/h4H,5H2,1-3H3.
What are the key properties of difluoro-methyl-(3-methylbut-2-enyl)silane?
difluoro-methyl-(3-methylbut-2-enyl)silane has a molecular weight of 150.24 g/mol, XLogP of 2.96, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for difluoro-methyl-(3-methylbut-2-enyl)silane is sourced from PubChem (CID 139667635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).