[4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane

C15H14BrF3Si — CID 10872070

IUPAC[4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc(-c2ccc(Br)c(F)c2)c(F)c1F
InChIInChI=1S/C15H14BrF3Si/c1-20(2,3)13-7-5-10(14(18)15(13)19)9-4-6-11(16)12(17)8-9/h4-8H,1-3H3
InChIKeyIDCGXXAJPVXDAL-UHFFFAOYSA-N
MW359.26 g/mol
LogP5.08
Rot. Bonds2

About [4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane

[4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane (PubChem CID 10872070) has the molecular formula C15H14BrF3Si and a molecular weight of 359.26 g/mol. Its IUPAC name is [4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane.

Molecular Properties

Compound Name[4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane
PubChem CID10872070
Molecular FormulaC15H14BrF3Si
Molecular Weight359.26 g/mol
Exact Mass358.00
IUPAC Name[4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc(-c2ccc(Br)c(F)c2)c(F)c1F
InChIInChI=1S/C15H14BrF3Si/c1-20(2,3)13-7-5-10(14(18)15(13)19)9-4-6-11(16)12(17)8-9/h4-8H,1-3H3
InChIKeyIDCGXXAJPVXDAL-UHFFFAOYSA-N
XLogP5.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.26
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[4-(4-bromophenyl)-2,3-difluorophenyl]-trimethylsilane
CID 10980755
4-(4-bromo-3-fluorophenyl)-1-methylpyrazol-5-amine
CID 117428222
2-(4-bromo-3-fluorophenyl)-4,6-dichloro-5-fluoropyrimidine
CID 81436237
1-(4-bromophenyl)-2,3-difluoro-4-methylbenzene
CID 58140910
1-[4-(4-bromo-3-chloro-2-fluorophenyl)-2-fluorophenyl]-N-methylmethanamine
CID 106763208
6-(4-bromo-3-fluorophenyl)-1,3,5-triazine-2,4-diamine
CID 112681578
1-bromo-2-fluoro-4-(4-propylphenyl)benzene
CID 19917644
[3-(4-bromo-3-fluorophenyl)pyrazin-2-yl]hydrazine
CID 112559522
[2-(4-bromo-3-fluorophenyl)-5-fluoro-6-methylpyrimidin-4-yl]hydrazine
CID 81441244
methyl 3-(3-fluoro-4-trimethylsilylphenyl)pyridine-2-carboxylate
CID 150115292
5-(4-bromo-3-fluorophenyl)-2H-tetrazole
CID 131599403
5-(4-bromo-3-fluorophenyl)-3,4-dihydro-2H-pyrrole
CID 66621338

Frequently Asked Questions

What is the IUPAC name of [4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane?
The IUPAC name of [4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane (CID 10872070) is [4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane.
What is the SMILES notation for [4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane?
The canonical SMILES for [4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane is C[Si](C)(C)c1ccc(-c2ccc(Br)c(F)c2)c(F)c1F.
What is the InChIKey of [4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane?
The InChIKey is IDCGXXAJPVXDAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrF3Si/c1-20(2,3)13-7-5-10(14(18)15(13)19)9-4-6-11(16)12(17)8-9/h4-8H,1-3H3.
What are the key properties of [4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane?
[4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane has a molecular weight of 359.26 g/mol, XLogP of 5.08, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-bromo-3-fluorophenyl)-2,3-difluorophenyl]-trimethylsilane is sourced from PubChem (CID 10872070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).