8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene

C46H36Si2 — CID 59182546

IUPAC8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene
SMILESC[Si]1(C)c2cc(-c3cccc4ccccc34)ccc2-c2ccc3c4c(ccc1c24)[Si](C)(C)c1cc(-c2cccc4ccccc24)ccc1-3
InChIInChI=1S/C46H36Si2/c1-47(2)41-25-26-42-46-40(38-22-20-32(28-44(38)48(42,3)4)36-18-10-14-30-12-6-8-16-34(30)36)24-23-39(45(41)46)37-21-19-31(27-43(37)47)35-17-9-13-29-11-5-7-15-33(29)35/h5-28H,1-4H3
InChIKeySEEDIDLFADQBNP-UHFFFAOYSA-N
MW644.97 g/mol
LogP10.09
Rot. Bonds2

About 8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene

8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene (PubChem CID 59182546) has the molecular formula C46H36Si2 and a molecular weight of 644.97 g/mol. Its IUPAC name is 8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene.

Molecular Properties

Compound Name8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene
PubChem CID59182546
Molecular FormulaC46H36Si2
Molecular Weight644.97 g/mol
Exact Mass644.24
IUPAC Name8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene
SMILESC[Si]1(C)c2cc(-c3cccc4ccccc34)ccc2-c2ccc3c4c(ccc1c24)[Si](C)(C)c1cc(-c2cccc4ccccc24)ccc1-3
InChIInChI=1S/C46H36Si2/c1-47(2)41-25-26-42-46-40(38-22-20-32(28-44(38)48(42,3)4)36-18-10-14-30-12-6-8-16-34(30)36)24-23-39(45(41)46)37-21-19-31(27-43(37)47)35-17-9-13-29-11-5-7-15-33(29)35/h5-28H,1-4H3
InChIKeySEEDIDLFADQBNP-UHFFFAOYSA-N
XLogP10.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500644.97
LogP ≤ 510.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene with MolForge

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Related Compounds

14-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-5-naphthalen-1-yl-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene
CID 153454251
8,8,13,13-tetramethyl-5,16-dinaphthalen-2-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene
CID 59181841
5,16-bis(4-tert-butylphenyl)-8,8,13,13-tetramethyl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene;8,8,13,13-tetramethyl-5,16-bis(3-methylphenyl)-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene;8,8,13,13-tetramethyl-5,16-bis(4-methylphenyl)-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene;8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene;8,8,13,13-tetramethyl-5,16-dinaphthalen-2-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene;8,8,13,13-tetramethyl-5,16-diphenyl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene
CID 159078124
2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-1-ylphenyl)-6-(2-phenylphenyl)-1,3,5-triazine
CID 159472836
2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 157199646
8,8,13,13-tetramethyl-5,16-bis(4-methylphenyl)-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene
CID 59182791
10,10-dimethyl-21-naphthalen-1-yl-7,14,17-triphenyl-10-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1,3(11),4(9),5,7,12,14,16,18,20-decaene
CID 173480620
10,10-dimethyl-14-naphthalen-1-yl-21-phenanthren-9-yl-7-phenyl-10-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,11,13,15,17,19-decaene
CID 91257294
10,10-dimethyl-7-(4-methylnaphthalen-1-yl)-17-naphthalen-1-yl-14,21-diphenyl-10-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4(9),5,7,11,15(20),16,18-nonaene-14,21-diol
CID 91590613
1-(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123841203
1,4-bis[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123399401
1-(2-methyl-4-naphthalen-1-ylphenyl)naphthalene
CID 145377660

Frequently Asked Questions

What is the IUPAC name of 8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene?
The IUPAC name of 8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene (CID 59182546) is 8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene.
What is the SMILES notation for 8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene?
The canonical SMILES for 8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene is C[Si]1(C)c2cc(-c3cccc4ccccc34)ccc2-c2ccc3c4c(ccc1c24)[Si](C)(C)c1cc(-c2cccc4ccccc24)ccc1-3.
What is the InChIKey of 8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene?
The InChIKey is SEEDIDLFADQBNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H36Si2/c1-47(2)41-25-26-42-46-40(38-22-20-32(28-44(38)48(42,3)4)36-18-10-14-30-12-6-8-16-34(30)36)24-23-39(45(41)46)37-21-19-31(27-43(37)47)35-17-9-13-29-11-5-7-15-33(29)35/h5-28H,1-4H3.
What are the key properties of 8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene?
8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene has a molecular weight of 644.97 g/mol, XLogP of 10.09, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8,13,13-tetramethyl-5,16-dinaphthalen-1-yl-8,13-disilahexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2(7),3,5,9,11,14(19),15,17,20(24),21-undecaene is sourced from PubChem (CID 59182546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).