difluoro-phenyl-propylsilane

C9H12F2Si — CID 569991

IUPACdifluoro-phenyl-propylsilane
SMILESCCC[Si](F)(F)c1ccccc1
InChIInChI=1S/C9H12F2Si/c1-2-8-12(10,11)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
InChIKeyXWKSFYJCJREPEN-UHFFFAOYSA-N
MW186.28 g/mol
LogP2.68
Rot. Bonds3

About difluoro-phenyl-propylsilane

difluoro-phenyl-propylsilane (PubChem CID 569991) has the molecular formula C9H12F2Si and a molecular weight of 186.28 g/mol. Its IUPAC name is difluoro-phenyl-propylsilane.

Molecular Properties

Compound Namedifluoro-phenyl-propylsilane
PubChem CID569991
Molecular FormulaC9H12F2Si
Molecular Weight186.28 g/mol
Exact Mass186.07
IUPAC Namedifluoro-phenyl-propylsilane
SMILESCCC[Si](F)(F)c1ccccc1
InChIInChI=1S/C9H12F2Si/c1-2-8-12(10,11)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
InChIKeyXWKSFYJCJREPEN-UHFFFAOYSA-N
XLogP2.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Dichloromethylphenylsilane
CID 9006
Ethylphenyldichlorosilane
CID 14304
(Dimethoxymethylsilyl)benzene
CID 18193
Chloro(methyl)diphenylsilane
CID 67349
Difluorodiphenylsilane
CID 67557
Diphenyldiallylsilane
CID 82695
Ethoxydimethylphenylsilane
CID 15770
Phenyl Dimethicone
CID 3032548
Chlorodimethylphenylsilane
CID 13029
(Chloromethyl)dimethylphenylsilane
CID 74598
Silanol, 1,1-dimethyl-1-phenyl-
CID 78929
Benzene, (dichloroethenylsilyl)-
CID 82138

Frequently Asked Questions

What is the IUPAC name of difluoro-phenyl-propylsilane?
The IUPAC name of difluoro-phenyl-propylsilane (CID 569991) is difluoro-phenyl-propylsilane.
What is the SMILES notation for difluoro-phenyl-propylsilane?
The canonical SMILES for difluoro-phenyl-propylsilane is CCC[Si](F)(F)c1ccccc1.
What is the InChIKey of difluoro-phenyl-propylsilane?
The InChIKey is XWKSFYJCJREPEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F2Si/c1-2-8-12(10,11)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3.
What are the key properties of difluoro-phenyl-propylsilane?
difluoro-phenyl-propylsilane has a molecular weight of 186.28 g/mol, XLogP of 2.68, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for difluoro-phenyl-propylsilane is sourced from PubChem (CID 569991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).