phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane

C38H26F6Si — CID 176748698

IUPACphenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane
SMILESFC(F)(F)c1ccccc1-c1ccc([Si](c2ccccc2)(c2ccc(-c3ccccc3)cc2)c2ccccc2C(F)(F)F)cc1
InChIInChI=1S/C38H26F6Si/c39-37(40,41)34-16-8-7-15-33(34)29-21-25-32(26-22-29)45(30-13-5-2-6-14-30,36-18-10-9-17-35(36)38(42,43)44)31-23-19-28(20-24-31)27-11-3-1-4-12-27/h1-26H
InChIKeyHZJCPQZGFRAOOY-UHFFFAOYSA-N
MW624.70 g/mol
LogP8.44
Rot. Bonds6

About phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane

phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane (PubChem CID 176748698) has the molecular formula C38H26F6Si and a molecular weight of 624.70 g/mol. Its IUPAC name is phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane.

Molecular Properties

Compound Namephenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane
PubChem CID176748698
Molecular FormulaC38H26F6Si
Molecular Weight624.70 g/mol
Exact Mass624.17
IUPAC Namephenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane
SMILESFC(F)(F)c1ccccc1-c1ccc([Si](c2ccccc2)(c2ccc(-c3ccccc3)cc2)c2ccccc2C(F)(F)F)cc1
InChIInChI=1S/C38H26F6Si/c39-37(40,41)34-16-8-7-15-33(34)29-21-25-32(26-22-29)45(30-13-5-2-6-14-30,36-18-10-9-17-35(36)38(42,43)44)31-23-19-28(20-24-31)27-11-3-1-4-12-27/h1-26H
InChIKeyHZJCPQZGFRAOOY-UHFFFAOYSA-N
XLogP8.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500624.70
LogP ≤ 58.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]benzene
CID 3013906
[4-[2-(trifluoromethyl)phenyl]phenyl]boronic acid
CID 175107537
N-methyl-1-[4-[2-(trifluoromethyl)phenyl]phenyl]methanamine
CID 58609638
1-tert-butyl-2-[4-(4-phenylphenyl)phenyl]benzene
CID 141150554
(4-fluorophenyl)-[4-(4-fluorophenyl)phenyl]-phenyl-(4-phenylphenyl)silane
CID 176748741
1-(1,1,2,2,2-pentafluoroethyl)-2-phenylbenzene
CID 139366997
1-tert-butyl-2-[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]benzene
CID 141427914
diphenyl-bis[4-(4-phenylnaphthalen-1-yl)phenyl]silane
CID 177495996
[5-[2-(trifluoromethyl)phenyl]-2-pyridinyl]methanamine
CID 131866305
1,2-difluoro-4-[2-(trifluoromethyl)phenyl]benzene
CID 91807915
5-(trifluoromethyl)-1,3-bis[2-(trifluoromethyl)phenyl]-2-[4-[2-(trifluoromethyl)phenyl]phenyl]benzene
CID 176828118
2-[4-[2-(trifluoromethyl)phenyl]phenyl]ethanamine
CID 82039542

Frequently Asked Questions

What is the IUPAC name of phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane?
The IUPAC name of phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane (CID 176748698) is phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane.
What is the SMILES notation for phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane?
The canonical SMILES for phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane is FC(F)(F)c1ccccc1-c1ccc([Si](c2ccccc2)(c2ccc(-c3ccccc3)cc2)c2ccccc2C(F)(F)F)cc1.
What is the InChIKey of phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane?
The InChIKey is HZJCPQZGFRAOOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H26F6Si/c39-37(40,41)34-16-8-7-15-33(34)29-21-25-32(26-22-29)45(30-13-5-2-6-14-30,36-18-10-9-17-35(36)38(42,43)44)31-23-19-28(20-24-31)27-11-3-1-4-12-27/h1-26H.
What are the key properties of phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane?
phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane has a molecular weight of 624.70 g/mol, XLogP of 8.44, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]-[4-[2-(trifluoromethyl)phenyl]phenyl]silane is sourced from PubChem (CID 176748698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).