2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane

C132H106Si — CID 162178187

IUPAC2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane
SMILESCC(C)(C)c1ccc2c(-c3ccc4ccccc4c3)c3ccccc3c(-c3ccccc3)c2c1.CC(C)(C)c1ccc2c(-c3cccc4ccccc34)c3ccccc3c(-c3ccccc3)c2c1.C[Si](C)(C)c1ccc2c(-c3cccc4ccccc34)c3ccccc3c(-c3ccccc3)c2c1.Cc1ccc2c(-c3ccc4ccccc4c3)c3ccccc3c(-c3ccccc3)c2c1
InChIInChI=1S/2C34H28.C33H28Si.C31H22/c1-34(2,3)25-20-21-30-31(22-25)32(24-13-5-4-6-14-24)28-17-9-10-18-29(28)33(30)27-19-11-15-23-12-7-8-16-26(23)27;1-34(2,3)27-19-20-30-31(22-27)32(24-12-5-4-6-13-24)28-15-9-10-16-29(28)33(30)26-18-17-23-11-7-8-14-25(23)21-26;1-34(2,3)25-20-21-30-31(22-25)32(24-13-5-4-6-14-24)28-17-9-10-18-29(28)33(30)27-19-11-15-23-12-7-8-16-26(23)27;1-21-15-18-28-29(19-21)30(23-10-3-2-4-11-23)26-13-7-8-14-27(26)31(28)25-17-16-22-9-5-6-12-24(22)20-25/h3*4-22H,1-3H3;2-20H,1H3
InChIKeyZORAOZNGSSLNOD-UHFFFAOYSA-N
MW1720.39 g/mol
LogP37.37
Rot. Bonds9

About 2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane

2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane (PubChem CID 162178187) has the molecular formula C132H106Si and a molecular weight of 1720.39 g/mol. Its IUPAC name is 2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane.

Molecular Properties

Compound Name2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane
PubChem CID162178187
Molecular FormulaC132H106Si
Molecular Weight1720.39 g/mol
Exact Mass1718.81
IUPAC Name2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane
SMILESCC(C)(C)c1ccc2c(-c3ccc4ccccc4c3)c3ccccc3c(-c3ccccc3)c2c1.CC(C)(C)c1ccc2c(-c3cccc4ccccc34)c3ccccc3c(-c3ccccc3)c2c1.C[Si](C)(C)c1ccc2c(-c3cccc4ccccc34)c3ccccc3c(-c3ccccc3)c2c1.Cc1ccc2c(-c3ccc4ccccc4c3)c3ccccc3c(-c3ccccc3)c2c1
InChIInChI=1S/2C34H28.C33H28Si.C31H22/c1-34(2,3)25-20-21-30-31(22-25)32(24-13-5-4-6-14-24)28-17-9-10-18-29(28)33(30)27-19-11-15-23-12-7-8-16-26(23)27;1-34(2,3)27-19-20-30-31(22-27)32(24-12-5-4-6-13-24)28-15-9-10-16-29(28)33(30)26-18-17-23-11-7-8-14-25(23)21-26;1-34(2,3)25-20-21-30-31(22-25)32(24-13-5-4-6-14-24)28-17-9-10-18-29(28)33(30)27-19-11-15-23-12-7-8-16-26(23)27;1-21-15-18-28-29(19-21)30(23-10-3-2-4-11-23)26-13-7-8-14-27(26)31(28)25-17-16-22-9-5-6-12-24(22)20-25/h3*4-22H,1-3H3;2-20H,1H3
InChIKeyZORAOZNGSSLNOD-UHFFFAOYSA-N
XLogP37.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms133
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001720.39
LogP ≤ 537.37
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_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane?
The IUPAC name of 2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane (CID 162178187) is 2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane.
What is the SMILES notation for 2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane?
The canonical SMILES for 2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane is CC(C)(C)c1ccc2c(-c3ccc4ccccc4c3)c3ccccc3c(-c3ccccc3)c2c1.CC(C)(C)c1ccc2c(-c3cccc4ccccc34)c3ccccc3c(-c3ccccc3)c2c1.C[Si](C)(C)c1ccc2c(-c3cccc4ccccc34)c3ccccc3c(-c3ccccc3)c2c1.Cc1ccc2c(-c3ccc4ccccc4c3)c3ccccc3c(-c3ccccc3)c2c1.
What is the InChIKey of 2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane?
The InChIKey is ZORAOZNGSSLNOD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C34H28.C33H28Si.C31H22/c1-34(2,3)25-20-21-30-31(22-25)32(24-13-5-4-6-14-24)28-17-9-10-18-29(28)33(30)27-19-11-15-23-12-7-8-16-26(23)27;1-34(2,3)27-19-20-30-31(22-27)32(24-12-5-4-6-13-24)28-15-9-10-16-29(28)33(30)26-18-17-23-11-7-8-14-25(23)21-26;1-34(2,3)25-20-21-30-31(22-25)32(24-13-5-4-6-14-24)28-17-9-10-18-29(28)33(30)27-19-11-15-23-12-7-8-16-26(23)27;1-21-15-18-28-29(19-21)30(23-10-3-2-4-11-23)26-13-7-8-14-27(26)31(28)25-17-16-22-9-5-6-12-24(22)20-25/h3*4-22H,1-3H3;2-20H,1H3.
What are the key properties of 2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane?
2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane has a molecular weight of 1720.39 g/mol, XLogP of 37.37, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-10-naphthalen-1-yl-9-phenylanthracene;2-tert-butyl-10-naphthalen-2-yl-9-phenylanthracene;2-methyl-10-naphthalen-2-yl-9-phenylanthracene;trimethyl-(10-naphthalen-1-yl-9-phenylanthracen-2-yl)silane is sourced from PubChem (CID 162178187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).