[2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane

C24H27FSi — CID 11002971

IUPAC[2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane
SMILESCCCc1ccc(-c2ccc(-c3ccc([Si](C)(C)C)c(F)c3)cc2)cc1
InChIInChI=1S/C24H27FSi/c1-5-6-18-7-9-19(10-8-18)20-11-13-21(14-12-20)22-15-16-24(23(25)17-22)26(2,3)4/h7-17H,5-6H2,1-4H3
InChIKeyWGLJQBJSCPDSFB-UHFFFAOYSA-N
MW362.56 g/mol
LogP6.66
Rot. Bonds5

About [2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane

[2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane (PubChem CID 11002971) has the molecular formula C24H27FSi and a molecular weight of 362.56 g/mol. Its IUPAC name is [2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane.

Molecular Properties

Compound Name[2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane
PubChem CID11002971
Molecular FormulaC24H27FSi
Molecular Weight362.56 g/mol
Exact Mass362.19
IUPAC Name[2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane
SMILESCCCc1ccc(-c2ccc(-c3ccc([Si](C)(C)C)c(F)c3)cc2)cc1
InChIInChI=1S/C24H27FSi/c1-5-6-18-7-9-19(10-8-18)20-11-13-21(14-12-20)22-15-16-24(23(25)17-22)26(2,3)4/h7-17H,5-6H2,1-4H3
InChIKeyWGLJQBJSCPDSFB-UHFFFAOYSA-N
XLogP6.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.56
LogP ≤ 56.66
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

2-fluoro-1-methyl-4-[4-(4-propylphenyl)phenyl]benzene
CID 59933450
1-bromo-2-fluoro-4-(4-propylphenyl)benzene
CID 19917644
1,3-difluoro-5-(4-propylphenyl)-2-(3,4,5-trifluorophenyl)benzene
CID 86196386
fluoromethane;1,2,3-trifluoro-5-[2-fluoro-4-(4-propylphenyl)phenyl]benzene
CID 161382729
2-fluoro-1-pentyl-4-(4-propylphenyl)benzene
CID 67842368
ethane;1,2,3-trifluoro-5-[2-fluoro-4-(4-propylphenyl)phenyl]benzene
CID 144658313
2-fluoro-4-(4-propylphenyl)benzonitrile
CID 15085130
1-fluoro-2,3-dimethyl-5-(4-propylphenyl)benzene
CID 143260820
1-[2-fluoro-4-(4-propylphenyl)phenyl]-N-methylmethanamine
CID 63424766
2,6-difluoro-4-[2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]aniline
CID 134427958
2-fluoro-4-[4-[2-(4-propylphenyl)ethyl]phenyl]benzonitrile
CID 14766020
[2,6-difluoro-4-(4-propylphenyl)phenyl]-[(4-fluorophenyl)methyl]-dimethylsilane
CID 59386273

Frequently Asked Questions

What is the IUPAC name of [2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane?
The IUPAC name of [2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane (CID 11002971) is [2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane.
What is the SMILES notation for [2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane?
The canonical SMILES for [2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane is CCCc1ccc(-c2ccc(-c3ccc([Si](C)(C)C)c(F)c3)cc2)cc1.
What is the InChIKey of [2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane?
The InChIKey is WGLJQBJSCPDSFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27FSi/c1-5-6-18-7-9-19(10-8-18)20-11-13-21(14-12-20)22-15-16-24(23(25)17-22)26(2,3)4/h7-17H,5-6H2,1-4H3.
What are the key properties of [2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane?
[2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane has a molecular weight of 362.56 g/mol, XLogP of 6.66, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2-fluoro-4-[4-(4-propylphenyl)phenyl]phenyl]-trimethylsilane is sourced from PubChem (CID 11002971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).