ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane

C138H279F3O8Si8 — CID 161087764

About ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane

ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane (PubChem CID 161087764) has the molecular formula C138H279F3O8Si8 and a molecular weight of 2348.42 g/mol. Its IUPAC name is ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane.

Molecular Properties

• Compound Name: ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane
• PubChem CID: 161087764
• Molecular Formula: C138H279F3O8Si8
• Molecular Weight: 2348.42 g/mol
• Exact Mass: 2345.95
• IUPAC Name: ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane
• SMILES: CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)(C)Oc1ccccc1.CC(C)(C)Oc1ccccc1.CC1(Oc2ccccc2)CCCC1.CC1(Oc2ccccc2)CCCCC1.CCC(C)(C)Oc1ccccc1.CCC(C)(C)Oc1ccccc1.CCCC(C)(C)Oc1ccccc1.CCCC(C)(C)Oc1ccccc1.CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CF.CF.CF
• InChI: InChI=1S/C13H18O.C12H16O.2C12H18O.2C11H16O.2C10H14O.8C3H10Si.10C2H6.3CH3F/c1-13(10-6-3-7-11-13)14-12-8-4-2-5-9-12;1-12(9-5-6-10-12)13-11-7-3-2-4-8-11;2*1-4-10-12(2,3)13-11-8-6-5-7-9-11;2*1-4-11(2,3)12-10-8-6-5-7-9-10;2*1-10(2,3)11-9-7-5-4-6-8-9;8*1-2-3-4;13*1-2/h2,4-5,8-9H,3,6-7,10-11H2,1H3;2-4,7-8H,5-6,9-10H2,1H3;2*5-9H,4,10H2,1-3H3;2*5-9H,4H2,1-3H3;2*4-8H,1-3H3;8*2-3H2,1,4H3;10*1-2H3;3*1H3
• InChIKey: UGTHBKUAKWLBQC-UHFFFAOYSA-N
• XLogP: 40.17
• TPSA: 73.84 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 28
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2348.42
LogP ≤ 5	40.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane?

The IUPAC name of ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane (CID 161087764) is ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane.

What is the SMILES notation for ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane?

The canonical SMILES for ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)(C)Oc1ccccc1.CC(C)(C)Oc1ccccc1.CC1(Oc2ccccc2)CCCC1.CC1(Oc2ccccc2)CCCCC1.CCC(C)(C)Oc1ccccc1.CCC(C)(C)Oc1ccccc1.CCCC(C)(C)Oc1ccccc1.CCCC(C)(C)Oc1ccccc1.CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CCC[SiH3].CF.CF.CF.

What is the InChIKey of ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane?

The InChIKey is UGTHBKUAKWLBQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O.C12H16O.2C12H18O.2C11H16O.2C10H14O.8C3H10Si.10C2H6.3CH3F/c1-13(10-6-3-7-11-13)14-12-8-4-2-5-9-12;1-12(9-5-6-10-12)13-11-7-3-2-4-8-11;2*1-4-10-12(2,3)13-11-8-6-5-7-9-11;2*1-4-11(2,3)12-10-8-6-5-7-9-10;2*1-10(2,3)11-9-7-5-4-6-8-9;8*1-2-3-4;13*1-2/h2,4-5,8-9H,3,6-7,10-11H2,1H3;2-4,7-8H,5-6,9-10H2,1H3;2*5-9H,4,10H2,1-3H3;2*5-9H,4H2,1-3H3;2*4-8H,1-3H3;8*2-3H2,1,4H3;10*1-2H3;3*1H3.

What are the key properties of ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane?

ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane has a molecular weight of 2348.42 g/mol, XLogP of 40.17, 28 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for ethane;fluoromethane;bis(2-methylbutan-2-yloxybenzene);(1-methylcyclohexyl)oxybenzene;(1-methylcyclopentyl)oxybenzene;bis(2-methylpentan-2-yloxybenzene);bis((2-methylpropan-2-yl)oxybenzene);propylsilane is sourced from PubChem (CID 161087764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).