2-(4-bromophenyl)ethyl-fluoro-dimethylsilane

C10H14BrFSi — CID 23650279

IUPAC2-(4-bromophenyl)ethyl-fluoro-dimethylsilane
SMILESC[Si](C)(F)CCc1ccc(Br)cc1
InChIInChI=1S/C10H14BrFSi/c1-13(2,12)8-7-9-3-5-10(11)6-4-9/h3-6H,7-8H2,1-2H3
InChIKeyIRKAAWOCILJPSG-UHFFFAOYSA-N
MW261.21 g/mol
LogP4.17
Rot. Bonds3

About 2-(4-bromophenyl)ethyl-fluoro-dimethylsilane

2-(4-bromophenyl)ethyl-fluoro-dimethylsilane (PubChem CID 23650279) has the molecular formula C10H14BrFSi and a molecular weight of 261.21 g/mol. Its IUPAC name is 2-(4-bromophenyl)ethyl-fluoro-dimethylsilane.

Molecular Properties

Compound Name2-(4-bromophenyl)ethyl-fluoro-dimethylsilane
PubChem CID23650279
Molecular FormulaC10H14BrFSi
Molecular Weight261.21 g/mol
Exact Mass260.00
IUPAC Name2-(4-bromophenyl)ethyl-fluoro-dimethylsilane
SMILESC[Si](C)(F)CCc1ccc(Br)cc1
InChIInChI=1S/C10H14BrFSi/c1-13(2,12)8-7-9-3-5-10(11)6-4-9/h3-6H,7-8H2,1-2H3
InChIKeyIRKAAWOCILJPSG-UHFFFAOYSA-N
XLogP4.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.21
LogP ≤ 54.17
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

1-bromo-4-[2-(4-bromophenyl)ethyl]benzene
CID 12594240
magnesium;1-bromo-4-propylbenzene;hydride
CID 173224874
1-bromo-4-(3,3-difluorobutyl)benzene
CID 84706880
1-bromo-4-(3-fluoro-3-methylbutyl)benzene
CID 84704942
1-bromo-4-ethylbenzene
CID 15313
acetonitrile;2-(4-bromophenyl)ethanol;ethane
CID 162439608
2-[2-(4-bromophenyl)ethyl]-1,3-dioxolane
CID 118022362
1-bromo-4-tetradecylbenzene
CID 71337489
1-bromo-4-dodecylbenzene
CID 15120506
1-bromo-4-hexadecylbenzene
CID 598602
3-(4-bromophenyl)propylsulfanyl-tri(propan-2-yl)silane
CID 46868830
2,4-bis(4-bromophenyl)-6-(4-hexylphenyl)-1,3,5-triazine
CID 59147599

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)ethyl-fluoro-dimethylsilane?
The IUPAC name of 2-(4-bromophenyl)ethyl-fluoro-dimethylsilane (CID 23650279) is 2-(4-bromophenyl)ethyl-fluoro-dimethylsilane.
What is the SMILES notation for 2-(4-bromophenyl)ethyl-fluoro-dimethylsilane?
The canonical SMILES for 2-(4-bromophenyl)ethyl-fluoro-dimethylsilane is C[Si](C)(F)CCc1ccc(Br)cc1.
What is the InChIKey of 2-(4-bromophenyl)ethyl-fluoro-dimethylsilane?
The InChIKey is IRKAAWOCILJPSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrFSi/c1-13(2,12)8-7-9-3-5-10(11)6-4-9/h3-6H,7-8H2,1-2H3.
What are the key properties of 2-(4-bromophenyl)ethyl-fluoro-dimethylsilane?
2-(4-bromophenyl)ethyl-fluoro-dimethylsilane has a molecular weight of 261.21 g/mol, XLogP of 4.17, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)ethyl-fluoro-dimethylsilane is sourced from PubChem (CID 23650279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).