[3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane

C186H192Si12 — CID 158932546

IUPAC[3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane
SMILESC[Si](C)(C)c1cc(-c2cc(-c3cc([Si](C)(C)C)cc([Si](C)(C)C)c3)c3ccc4c(-c5ccc(-c6ccccc6)c6ccccc56)cc(-c5cc([Si](C)(C)C)cc([Si](C)(C)C)c5)c5ccc2c3c54)cc([Si](C)(C)C)c1.C[Si](C)(C)c1cccc(-c2cc(-c3cccc([Si](C)(C)C)c3)c3ccc4c(-c5ccc(-c6ccccc6)c6ccccc56)cc(-c5cccc([Si](C)(C)C)c5)c5ccc2c3c54)c1.C[Si](C)(C)c1ccccc1-c1cc(-c2ccccc2[Si](C)(C)C)c2ccc3c(-c4ccc(-c5ccccc5)c5ccccc45)cc(-c4ccccc4[Si](C)(C)C)c4ccc1c2c43
InChIInChI=1S/C68H80Si6.2C59H56Si3/c1-69(2,3)49-34-46(35-50(40-49)70(4,5)6)63-43-64(47-36-51(71(7,8)9)41-52(37-47)72(10,11)12)60-32-33-62-66(58-29-28-55(45-24-20-19-21-25-45)56-26-22-23-27-57(56)58)44-65(61-31-30-59(63)67(60)68(61)62)48-38-53(73(13,14)15)42-54(39-48)74(16,17)18;1-60(2,3)55-28-18-15-25-44(55)52-37-51(43-32-31-40(39-21-11-10-12-22-39)41-23-13-14-24-42(41)43)47-33-34-49-53(45-26-16-19-29-56(45)61(4,5)6)38-54(50-36-35-48(52)58(47)59(49)50)46-27-17-20-30-57(46)62(7,8)9;1-60(2,3)43-23-15-20-40(34-43)54-37-55(41-21-16-24-44(35-41)61(4,5)6)51-32-33-53-57(49-29-28-46(39-18-11-10-12-19-39)47-26-13-14-27-48(47)49)38-56(52-31-30-50(54)58(51)59(52)53)42-22-17-25-45(36-42)62(7,8)9/h19-44H,1-18H3;2*10-38H,1-9H3
InChIKeyJJGAZZAFVYLAMG-UHFFFAOYSA-N
MW2764.61 g/mol
LogP48.76
Rot. Bonds27

About [3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane

[3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane (PubChem CID 158932546) has the molecular formula C186H192Si12 and a molecular weight of 2764.61 g/mol. Its IUPAC name is [3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane.

Molecular Properties

Compound Name[3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane
PubChem CID158932546
Molecular FormulaC186H192Si12
Molecular Weight2764.61 g/mol
Exact Mass2761.23
IUPAC Name[3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane
SMILESC[Si](C)(C)c1cc(-c2cc(-c3cc([Si](C)(C)C)cc([Si](C)(C)C)c3)c3ccc4c(-c5ccc(-c6ccccc6)c6ccccc56)cc(-c5cc([Si](C)(C)C)cc([Si](C)(C)C)c5)c5ccc2c3c54)cc([Si](C)(C)C)c1.C[Si](C)(C)c1cccc(-c2cc(-c3cccc([Si](C)(C)C)c3)c3ccc4c(-c5ccc(-c6ccccc6)c6ccccc56)cc(-c5cccc([Si](C)(C)C)c5)c5ccc2c3c54)c1.C[Si](C)(C)c1ccccc1-c1cc(-c2ccccc2[Si](C)(C)C)c2ccc3c(-c4ccc(-c5ccccc5)c5ccccc45)cc(-c4ccccc4[Si](C)(C)C)c4ccc1c2c43
InChIInChI=1S/C68H80Si6.2C59H56Si3/c1-69(2,3)49-34-46(35-50(40-49)70(4,5)6)63-43-64(47-36-51(71(7,8)9)41-52(37-47)72(10,11)12)60-32-33-62-66(58-29-28-55(45-24-20-19-21-25-45)56-26-22-23-27-57(56)58)44-65(61-31-30-59(63)67(60)68(61)62)48-38-53(73(13,14)15)42-54(39-48)74(16,17)18;1-60(2,3)55-28-18-15-25-44(55)52-37-51(43-32-31-40(39-21-11-10-12-22-39)41-23-13-14-24-42(41)43)47-33-34-49-53(45-26-16-19-29-56(45)61(4,5)6)38-54(50-36-35-48(52)58(47)59(49)50)46-27-17-20-30-57(46)62(7,8)9;1-60(2,3)43-23-15-20-40(34-43)54-37-55(41-21-16-24-44(35-41)61(4,5)6)51-32-33-53-57(49-29-28-46(39-18-11-10-12-19-39)47-26-13-14-27-48(47)49)38-56(52-31-30-50(54)58(51)59(52)53)42-22-17-25-45(36-42)62(7,8)9/h19-44H,1-18H3;2*10-38H,1-9H3
InChIKeyJJGAZZAFVYLAMG-UHFFFAOYSA-N
XLogP48.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds27
Heavy Atoms198
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002764.61
LogP ≤ 548.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze [3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane with MolForge

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Related Compounds

1-phenyl-3,6,8-tris(2-phenylphenyl)pyrene;trimethyl-[4-[3-phenyl-6,8-bis(4-trimethylsilylnaphthalen-1-yl)pyren-1-yl]naphthalen-1-yl]silane;1,3,6-tris(3,5-diphenylphenyl)-8-phenylpyrene
CID 159096469
[4-[3,8-bis(4-phenylnaphthalen-1-yl)-6-(4-trimethylsilylnaphthalen-1-yl)pyren-1-yl]naphthalen-1-yl]-trimethylsilane;1,6-dinaphthalen-1-yl-3,8-bis(4-phenylnaphthalen-1-yl)pyrene;1,6-di(phenanthren-9-yl)-3,8-bis(4-phenylnaphthalen-1-yl)pyrene
CID 162208295
1,3,6,8-tetra(phenanthren-9-yl)pyrene;trimethyl-[4-[3,6,8-tri(phenanthren-9-yl)pyren-1-yl]naphthalen-1-yl]silane;1,3,6-tri(phenanthren-9-yl)-8-phenylpyrene
CID 160979327
1,6-bis(4-phenylnaphthalen-1-yl)-3,8-bis(2-phenylphenyl)pyrene
CID 59391228
[3-[6-[3,5-bis(trimethylsilyl)phenyl]-3,8-bis(4-methylphenyl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane
CID 59391032
[4-[3,8-bis(4-methylphenyl)-6-(4-trimethylsilylnaphthalen-1-yl)pyren-1-yl]naphthalen-1-yl]-trimethylsilane
CID 59391126
1,8-dinaphthalen-1-ylpyrene;1,3,6,8-tetraphenylpyrene;trimethyl-[2,3,5,6-tetradeuterio-4-[6-(2,3,5,6-tetradeuterio-4-trimethylsilylphenyl)pyren-1-yl]phenyl]silane
CID 160911824
trimethyl-[4-[3,6,8-tris(3,5-diphenylphenyl)pyren-1-yl]phenyl]silane
CID 59391113
1,6-dinaphthalen-1-yl-3,8-diphenylpyrene
CID 59391123
1,3-bis(3-naphthalen-1-ylphenyl)-6,8-diphenylpyrene
CID 170778741
1,3,6-triphenyl-8-[3-(1,6,8-triphenylpyren-4-yl)-5-(3,6,8-triphenylpyren-1-yl)phenyl]pyrene
CID 59993828
1,6-bis(4-phenylnaphthalen-1-yl)-3,8-bis(3-phenylphenyl)pyrene;1,6-bis(4-phenylnaphthalen-1-yl)-3,8-bis(4-phenylphenyl)pyrene;1,6-dinaphthalen-2-yl-3,8-bis(4-phenylnaphthalen-1-yl)pyrene
CID 157103294

Frequently Asked Questions

What is the IUPAC name of [3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane?
The IUPAC name of [3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane (CID 158932546) is [3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane.
What is the SMILES notation for [3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane?
The canonical SMILES for [3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane is C[Si](C)(C)c1cc(-c2cc(-c3cc([Si](C)(C)C)cc([Si](C)(C)C)c3)c3ccc4c(-c5ccc(-c6ccccc6)c6ccccc56)cc(-c5cc([Si](C)(C)C)cc([Si](C)(C)C)c5)c5ccc2c3c54)cc([Si](C)(C)C)c1.C[Si](C)(C)c1cccc(-c2cc(-c3cccc([Si](C)(C)C)c3)c3ccc4c(-c5ccc(-c6ccccc6)c6ccccc56)cc(-c5cccc([Si](C)(C)C)c5)c5ccc2c3c54)c1.C[Si](C)(C)c1ccccc1-c1cc(-c2ccccc2[Si](C)(C)C)c2ccc3c(-c4ccc(-c5ccccc5)c5ccccc45)cc(-c4ccccc4[Si](C)(C)C)c4ccc1c2c43.
What is the InChIKey of [3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane?
The InChIKey is JJGAZZAFVYLAMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H80Si6.2C59H56Si3/c1-69(2,3)49-34-46(35-50(40-49)70(4,5)6)63-43-64(47-36-51(71(7,8)9)41-52(37-47)72(10,11)12)60-32-33-62-66(58-29-28-55(45-24-20-19-21-25-45)56-26-22-23-27-57(56)58)44-65(61-31-30-59(63)67(60)68(61)62)48-38-53(73(13,14)15)42-54(39-48)74(16,17)18;1-60(2,3)55-28-18-15-25-44(55)52-37-51(43-32-31-40(39-21-11-10-12-22-39)41-23-13-14-24-42(41)43)47-33-34-49-53(45-26-16-19-29-56(45)61(4,5)6)38-54(50-36-35-48(52)58(47)59(49)50)46-27-17-20-30-57(46)62(7,8)9;1-60(2,3)43-23-15-20-40(34-43)54-37-55(41-21-16-24-44(35-41)61(4,5)6)51-32-33-53-57(49-29-28-46(39-18-11-10-12-19-39)47-26-13-14-27-48(47)49)38-56(52-31-30-50(54)58(51)59(52)53)42-22-17-25-45(36-42)62(7,8)9/h19-44H,1-18H3;2*10-38H,1-9H3.
What are the key properties of [3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane?
[3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane has a molecular weight of 2764.61 g/mol, XLogP of 48.76, 27 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[3,6-bis[3,5-bis(trimethylsilyl)phenyl]-8-(4-phenylnaphthalen-1-yl)pyren-1-yl]-5-trimethylsilylphenyl]-trimethylsilane;trimethyl-[2-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(2-trimethylsilylphenyl)pyren-1-yl]phenyl]silane;trimethyl-[3-[3-(4-phenylnaphthalen-1-yl)-6,8-bis(3-trimethylsilylphenyl)pyren-1-yl]phenyl]silane is sourced from PubChem (CID 158932546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).