[4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane

C73H116Si2 — CID 166038593

About [4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane

[4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane (PubChem CID 166038593) has the molecular formula C73H116Si2 and a molecular weight of 1049.90 g/mol. Its IUPAC name is [4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane.

Molecular Properties

• Compound Name: [4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane
• PubChem CID: 166038593
• Molecular Formula: C73H116Si2
• Molecular Weight: 1049.90 g/mol
• Exact Mass: 1048.86
• IUPAC Name: [4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane
• SMILES: CC1CC2C(CCCCCC3CCCC4C3CC(C)C4[Si](C)(C)C3C(C)CC4C(C5CCCCC5c5ccccc5)CCCC43)CCCC2C1[Si](C)(C)C1C(C)CC2C(C3CCCCC3c3ccccc3)CCCC21
• InChI: InChI=1S/C73H116Si2/c1-48-44-66-54(32-22-40-62(66)70(48)74(5,6)72-50(3)46-68-60(38-24-42-64(68)72)58-36-20-18-34-56(58)52-26-12-9-13-27-52)30-16-11-17-31-55-33-23-41-63-67(55)45-49(2)71(63)75(7,8)73-51(4)47-69-61(39-25-43-65(69)73)59-37-21-19-35-57(59)53-28-14-10-15-29-53/h9-10,12-15,26-29,48-51,54-73H,11,16-25,30-47H2,1-8H3
• InChIKey: PSQWCGJSLIMIHP-UHFFFAOYSA-N
• XLogP: 22.07
• TPSA: 0.00 Ų
• Rotatable Bonds: 14
• Heavy Atoms: 75
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1049.90
LogP ≤ 5	22.07
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane?

The IUPAC name of [4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane (CID 166038593) is [4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane.

What is the SMILES notation for [4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane?

The canonical SMILES for [4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane is CC1CC2C(CCCCCC3CCCC4C3CC(C)C4[Si](C)(C)C3C(C)CC4C(C5CCCCC5c5ccccc5)CCCC43)CCCC2C1[Si](C)(C)C1C(C)CC2C(C3CCCCC3c3ccccc3)CCCC21.

What is the InChIKey of [4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane?

The InChIKey is PSQWCGJSLIMIHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H116Si2/c1-48-44-66-54(32-22-40-62(66)70(48)74(5,6)72-50(3)46-68-60(38-24-42-64(68)72)58-36-20-18-34-56(58)52-26-12-9-13-27-52)30-16-11-17-31-55-33-23-41-63-67(55)45-49(2)71(63)75(7,8)73-51(4)47-69-61(39-25-43-65(69)73)59-37-21-19-35-57(59)53-28-14-10-15-29-53/h9-10,12-15,26-29,48-51,54-73H,11,16-25,30-47H2,1-8H3.

What are the key properties of [4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane?

[4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane has a molecular weight of 1049.90 g/mol, XLogP of 22.07, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[5-[1-[dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-yl]pentyl]-2-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]-dimethyl-[2-methyl-4-(2-phenylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl]silane is sourced from PubChem (CID 166038593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).