trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane

C38H31F3Si — CID 169293833

IUPACtrimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane
SMILESC[Si](C)(C)c1ccc(-c2ccc(-c3ccc4ccc(-c5ccc(-c6ccc(C(F)(F)F)cc6)cc5)cc4c3)cc2)cc1
InChIInChI=1S/C38H31F3Si/c1-42(2,3)37-22-18-29(19-23-37)27-6-10-31(11-7-27)34-15-13-32-12-14-33(24-35(32)25-34)30-8-4-26(5-9-30)28-16-20-36(21-17-28)38(39,40)41/h4-25H,1-3H3
InChIKeyLVOSNVKPQQSVBK-UHFFFAOYSA-N
MW572.75 g/mol
LogP11.07
Rot. Bonds5

About trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane

trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane (PubChem CID 169293833) has the molecular formula C38H31F3Si and a molecular weight of 572.75 g/mol. Its IUPAC name is trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane.

Molecular Properties

Compound Nametrimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane
PubChem CID169293833
Molecular FormulaC38H31F3Si
Molecular Weight572.75 g/mol
Exact Mass572.21
IUPAC Nametrimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane
SMILESC[Si](C)(C)c1ccc(-c2ccc(-c3ccc4ccc(-c5ccc(-c6ccc(C(F)(F)F)cc6)cc5)cc4c3)cc2)cc1
InChIInChI=1S/C38H31F3Si/c1-42(2,3)37-22-18-29(19-23-37)27-6-10-31(11-7-27)34-15-13-32-12-14-33(24-35(32)25-34)30-8-4-26(5-9-30)28-16-20-36(21-17-28)38(39,40)41/h4-25H,1-3H3
InChIKeyLVOSNVKPQQSVBK-UHFFFAOYSA-N
XLogP11.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500572.75
LogP ≤ 511.07
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

trimethyl-[4-[4-[7-(4-trimethylsilylphenyl)naphthalen-2-yl]phenyl]phenyl]silane
CID 169293615
trimethyl-[4-[3-[4-[4-(trifluoromethyl)phenyl]phenyl]quinolin-7-yl]phenyl]silane
CID 169293955
trimethyl-[4-[4-[3-[4-[4-(trifluoromethyl)phenyl]phenyl]quinolin-7-yl]phenyl]phenyl]silane
CID 169293948
trimethyl-[4-[5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]-2-pyridinyl]phenyl]silane
CID 169293659
trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane
CID 102366685
2-[4-(trifluoromethyl)phenyl]naphthalene
CID 11448652
trimethyl-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]silane
CID 171056374
2-[4-[4-[4-(trifluoromethyl)phenyl]phenyl]phenyl]naphthalene
CID 171056262
[4-[5-[7-[3,5-bis(trifluoromethyl)phenyl]naphthalen-2-yl]-2-pyridinyl]phenyl]-trimethylsilane
CID 169294031
4-[4-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]phenyl]pyridine
CID 169293640
[4-[4-[6-[4-(4-fluorophenyl)phenyl]naphthalen-2-yl]phenyl]phenyl]-trimethylsilane
CID 169293793
2-methyl-6-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalene
CID 162565704

Frequently Asked Questions

What is the IUPAC name of trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane?
The IUPAC name of trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane (CID 169293833) is trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane.
What is the SMILES notation for trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane?
The canonical SMILES for trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane is C[Si](C)(C)c1ccc(-c2ccc(-c3ccc4ccc(-c5ccc(-c6ccc(C(F)(F)F)cc6)cc5)cc4c3)cc2)cc1.
What is the InChIKey of trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane?
The InChIKey is LVOSNVKPQQSVBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H31F3Si/c1-42(2,3)37-22-18-29(19-23-37)27-6-10-31(11-7-27)34-15-13-32-12-14-33(24-35(32)25-34)30-8-4-26(5-9-30)28-16-20-36(21-17-28)38(39,40)41/h4-25H,1-3H3.
What are the key properties of trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane?
trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane has a molecular weight of 572.75 g/mol, XLogP of 11.07, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane is sourced from PubChem (CID 169293833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).