trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane

C54H51F9Si3 — CID 102366685

IUPACtrimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane
SMILESC[Si](C)(C)c1ccc(-c2c(-c3ccc(C(F)(F)F)cc3)c(-c3ccc([Si](C)(C)C)cc3)c(-c3ccc(C(F)(F)F)cc3)c(-c3ccc([Si](C)(C)C)cc3)c2-c2ccc(C(F)(F)F)cc2)cc1
InChIInChI=1S/C54H51F9Si3/c1-64(2,3)43-28-16-37(17-29-43)49-46(34-10-22-40(23-11-34)52(55,56)57)50(38-18-30-44(31-19-38)65(4,5)6)48(36-14-26-42(27-15-36)54(61,62)63)51(39-20-32-45(33-21-39)66(7,8)9)47(49)35-12-24-41(25-13-35)53(58,59)60/h10-33H,1-9H3
InChIKeyLXZRXAWBKIQGEL-UHFFFAOYSA-N
MW955.24 g/mol
LogP16.38
Rot. Bonds9

About trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane

trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane (PubChem CID 102366685) has the molecular formula C54H51F9Si3 and a molecular weight of 955.24 g/mol. Its IUPAC name is trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane.

Molecular Properties

Compound Nametrimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane
PubChem CID102366685
Molecular FormulaC54H51F9Si3
Molecular Weight955.24 g/mol
Exact Mass954.32
IUPAC Nametrimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane
SMILESC[Si](C)(C)c1ccc(-c2c(-c3ccc(C(F)(F)F)cc3)c(-c3ccc([Si](C)(C)C)cc3)c(-c3ccc(C(F)(F)F)cc3)c(-c3ccc([Si](C)(C)C)cc3)c2-c2ccc(C(F)(F)F)cc2)cc1
InChIInChI=1S/C54H51F9Si3/c1-64(2,3)43-28-16-37(17-29-43)49-46(34-10-22-40(23-11-34)52(55,56)57)50(38-18-30-44(31-19-38)65(4,5)6)48(36-14-26-42(27-15-36)54(61,62)63)51(39-20-32-45(33-21-39)66(7,8)9)47(49)35-12-24-41(25-13-35)53(58,59)60/h10-33H,1-9H3
InChIKeyLXZRXAWBKIQGEL-UHFFFAOYSA-N
XLogP16.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms66
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500955.24
LogP ≤ 516.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane with MolForge

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Related Compounds

trimethyl-[4-[4-[7-[4-[4-(trifluoromethyl)phenyl]phenyl]naphthalen-2-yl]phenyl]phenyl]silane
CID 169293833
1-[4-(trifluoromethyl)phenyl]-1-(4-trimethylsilylphenyl)ethanol
CID 101475604
(4-tert-butylphenyl)-trimethylsilane
CID 605751
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-[(1E,3Z,5Z,7Z)-2-[4-(trifluoromethyl)phenyl]-3,4-bis(trimethylsilyl)cycloocta-1,3,5,7-tetraen-1-yl]silane
CID 177431862
trimethyl-[4-[5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]-2-pyridinyl]phenyl]silane
CID 169293659
[9-[6-[3,6-bis(trimethylsilyl)carbazol-9-yl]-9,10-bis[4-[4-(trifluoromethyl)phenyl]phenyl]anthracen-2-yl]-6-trimethylsilylcarbazol-3-yl]-trimethylsilane
CID 59357292
1-methyl-4-[4-[4-[4-(trifluoromethyl)phenyl]phenyl]phenyl]benzene
CID 59630308
trihydroxy-[4-[4-(trifluoromethyl)phenyl]phenyl]silane
CID 90172329
1,2,3,4,5-pentachloro-6-[4-(trifluoromethyl)phenyl]benzene
CID 118809445
2,3,6-triphenyl-4,5-bis[4-(trifluoromethyl)phenyl]pyridine
CID 102130644

Frequently Asked Questions

What is the IUPAC name of trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane?
The IUPAC name of trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane (CID 102366685) is trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane.
What is the SMILES notation for trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane?
The canonical SMILES for trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane is C[Si](C)(C)c1ccc(-c2c(-c3ccc(C(F)(F)F)cc3)c(-c3ccc([Si](C)(C)C)cc3)c(-c3ccc(C(F)(F)F)cc3)c(-c3ccc([Si](C)(C)C)cc3)c2-c2ccc(C(F)(F)F)cc2)cc1.
What is the InChIKey of trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane?
The InChIKey is LXZRXAWBKIQGEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H51F9Si3/c1-64(2,3)43-28-16-37(17-29-43)49-46(34-10-22-40(23-11-34)52(55,56)57)50(38-18-30-44(31-19-38)65(4,5)6)48(36-14-26-42(27-15-36)54(61,62)63)51(39-20-32-45(33-21-39)66(7,8)9)47(49)35-12-24-41(25-13-35)53(58,59)60/h10-33H,1-9H3.
What are the key properties of trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane?
trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane has a molecular weight of 955.24 g/mol, XLogP of 16.38, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-[2,4,6-tris[4-(trifluoromethyl)phenyl]-3,5-bis(4-trimethylsilylphenyl)phenyl]phenyl]silane is sourced from PubChem (CID 102366685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).