tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane

C140H122Si2 — CID 101355529

About tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane

tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane (PubChem CID 101355529) has the molecular formula C140H122Si2 and a molecular weight of 1860.69 g/mol. Its IUPAC name is tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane.

Molecular Properties

• Compound Name: tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane
• PubChem CID: 101355529
• Molecular Formula: C140H122Si2
• Molecular Weight: 1860.69 g/mol
• Exact Mass: 1858.91
• IUPAC Name: tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane
• SMILES: CC(C)c1c2cccc(C#Cc3cccc4cc5cccc(C#Cc6cccc7c(C(C)C)c8cccc(C#Cc9cccc%10cc%11cccc(C#Cc%12cccc%13c(C(C)C)c%14cccc([Si](C(C)C)(C(C)C)C(C)C)c%14cc%12%13)c%11cc9%10)c8cc67)c5cc34)c2cc2c(C#Cc3cccc4cc5cccc(C#Cc6cccc7c(C(C)C)c8cccc([Si](C(C)C)(C(C)C)C(C)C)c8cc67)c5cc34)cccc12
• InChI: InChI=1S/C140H122Si2/c1-85(2)137-113-53-27-41-101(127(113)81-129-103(43-29-55-115(129)137)71-65-97-37-23-49-109-76-111-51-25-39-99(125(111)79-123(97)109)67-73-105-45-31-57-117-131(105)83-133-119(139(117)87(5)6)59-33-61-135(133)141(89(9)10,90(11)12)91(13)14)69-63-95-35-21-47-107-75-108-48-22-36-96(122(108)78-121(95)107)64-70-102-42-28-54-114-128(102)82-130-104(44-30-56-116(130)138(114)86(3)4)72-66-98-38-24-50-110-77-112-52-26-40-100(126(112)80-124(98)110)68-74-106-46-32-58-118-132(106)84-134-120(140(118)88(7)8)60-34-62-136(134)142(92(15)16,93(17)18)94(19)20/h21-62,75-94H,1-20H3
• InChIKey: AQVDTBGQTJAWLI-UHFFFAOYSA-N
• XLogP: 36.50
• TPSA: 0.00 Ų
• Rotatable Bonds: 12
• Heavy Atoms: 142
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1860.69
LogP ≤ 5	36.50
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane?

The IUPAC name of tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane (CID 101355529) is tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane.

What is the SMILES notation for tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane?

The canonical SMILES for tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane is CC(C)c1c2cccc(C#Cc3cccc4cc5cccc(C#Cc6cccc7c(C(C)C)c8cccc(C#Cc9cccc%10cc%11cccc(C#Cc%12cccc%13c(C(C)C)c%14cccc([Si](C(C)C)(C(C)C)C(C)C)c%14cc%12%13)c%11cc9%10)c8cc67)c5cc34)c2cc2c(C#Cc3cccc4cc5cccc(C#Cc6cccc7c(C(C)C)c8cccc([Si](C(C)C)(C(C)C)C(C)C)c8cc67)c5cc34)cccc12.

What is the InChIKey of tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane?

The InChIKey is AQVDTBGQTJAWLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C140H122Si2/c1-85(2)137-113-53-27-41-101(127(113)81-129-103(43-29-55-115(129)137)71-65-97-37-23-49-109-76-111-51-25-39-99(125(111)79-123(97)109)67-73-105-45-31-57-117-131(105)83-133-119(139(117)87(5)6)59-33-61-135(133)141(89(9)10,90(11)12)91(13)14)69-63-95-35-21-47-107-75-108-48-22-36-96(122(108)78-121(95)107)64-70-102-42-28-54-114-128(102)82-130-104(44-30-56-116(130)138(114)86(3)4)72-66-98-38-24-50-110-77-112-52-26-40-100(126(112)80-124(98)110)68-74-106-46-32-58-118-132(106)84-134-120(140(118)88(7)8)60-34-62-136(134)142(92(15)16,93(17)18)94(19)20/h21-62,75-94H,1-20H3.

What are the key properties of tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane?

tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane has a molecular weight of 1860.69 g/mol, XLogP of 36.50, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for tri(propan-2-yl)-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-[2-[8-[2-[10-propan-2-yl-8-tri(propan-2-yl)silylanthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]ethynyl]anthracen-1-yl]silane is sourced from PubChem (CID 101355529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).