tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane

C128H236F4O16Si10 — CID 160831441

About tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane

tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane (PubChem CID 160831441) has the molecular formula C128H236F4O16Si10 and a molecular weight of 2388.13 g/mol. Its IUPAC name is tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane.

Molecular Properties

• Compound Name: tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane
• PubChem CID: 160831441
• Molecular Formula: C128H236F4O16Si10
• Molecular Weight: 2388.13 g/mol
• Exact Mass: 2385.53
• IUPAC Name: tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane
• SMILES: CC(C)(C)OC(=O)Oc1ccccc1.CC(C)(C)Oc1ccccc1.CC(C)(C)[Si](C)(C)Oc1ccccc1.CC1(Oc2ccccc2)CCCC1.CC1(Oc2ccccc2)CCCC1.CC1(Oc2ccccc2)CCCCC1.CCC(C)(C)Oc1ccccc1.CCCC(C)(C)Oc1ccccc1.CCOC(C)Oc1ccccc1.CF.CF.CF.CF.COCCC[SiH3].COCCC[SiH3].COCCC[SiH3].COCCC[SiH3].C[SiH3].C[SiH3].C[SiH3].C[SiH3].C[SiH3]
• InChI: InChI=1S/C13H18O.C12H20OSi.2C12H16O.C12H18O.C11H14O3.C11H16O.C10H14O2.C10H14O.4C4H12OSi.4CH3F.5CH6Si/c1-13(10-6-3-7-11-13)14-12-8-4-2-5-9-12;1-12(2,3)14(4,5)13-11-9-7-6-8-10-11;2*1-12(9-5-6-10-12)13-11-7-3-2-4-8-11;1-4-10-12(2,3)13-11-8-6-5-7-9-11;1-11(2,3)14-10(12)13-9-7-5-4-6-8-9;1-4-11(2,3)12-10-8-6-5-7-9-10;1-3-11-9(2)12-10-7-5-4-6-8-10;1-10(2,3)11-9-7-5-4-6-8-9;4*1-5-3-2-4-6;9*1-2/h2,4-5,8-9H,3,6-7,10-11H2,1H3;6-10H,1-5H3;2*2-4,7-8H,5-6,9-10H2,1H3;5-9H,4,10H2,1-3H3;4-8H,1-3H3;5-9H,4H2,1-3H3;4-9H,3H2,1-2H3;4-8H,1-3H3;4*2-4H2,1,6H3;4*1H3;5*1-2H3
• InChIKey: SGVSNGGNUDLHCH-UHFFFAOYSA-N
• XLogP: 28.43
• TPSA: 155.52 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 33
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2388.13
LogP ≤ 5	28.43
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phenyl_carbonate', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane?

The IUPAC name of tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane (CID 160831441) is tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane.

What is the SMILES notation for tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane?

The canonical SMILES for tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane is CC(C)(C)OC(=O)Oc1ccccc1.CC(C)(C)Oc1ccccc1.CC(C)(C)[Si](C)(C)Oc1ccccc1.CC1(Oc2ccccc2)CCCC1.CC1(Oc2ccccc2)CCCC1.CC1(Oc2ccccc2)CCCCC1.CCC(C)(C)Oc1ccccc1.CCCC(C)(C)Oc1ccccc1.CCOC(C)Oc1ccccc1.CF.CF.CF.CF.COCCC[SiH3].COCCC[SiH3].COCCC[SiH3].COCCC[SiH3].C[SiH3].C[SiH3].C[SiH3].C[SiH3].C[SiH3].

What is the InChIKey of tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane?

The InChIKey is SGVSNGGNUDLHCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O.C12H20OSi.2C12H16O.C12H18O.C11H14O3.C11H16O.C10H14O2.C10H14O.4C4H12OSi.4CH3F.5CH6Si/c1-13(10-6-3-7-11-13)14-12-8-4-2-5-9-12;1-12(2,3)14(4,5)13-11-9-7-6-8-10-11;2*1-12(9-5-6-10-12)13-11-7-3-2-4-8-11;1-4-10-12(2,3)13-11-8-6-5-7-9-11;1-11(2,3)14-10(12)13-9-7-5-4-6-8-9;1-4-11(2,3)12-10-8-6-5-7-9-10;1-3-11-9(2)12-10-7-5-4-6-8-10;1-10(2,3)11-9-7-5-4-6-8-9;4*1-5-3-2-4-6;9*1-2/h2,4-5,8-9H,3,6-7,10-11H2,1H3;6-10H,1-5H3;2*2-4,7-8H,5-6,9-10H2,1H3;5-9H,4,10H2,1-3H3;4-8H,1-3H3;5-9H,4H2,1-3H3;4-9H,3H2,1-2H3;4-8H,1-3H3;4*2-4H2,1,6H3;4*1H3;5*1-2H3.

What are the key properties of tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane?

tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane has a molecular weight of 2388.13 g/mol, XLogP of 28.43, 33 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl-dimethyl-phenoxysilane;tert-butyl phenyl carbonate;1-ethoxyethoxybenzene;fluoromethane;tetrakis(3-methoxypropylsilane);2-methylbutan-2-yloxybenzene;(1-methylcyclohexyl)oxybenzene;bis((1-methylcyclopentyl)oxybenzene);2-methylpentan-2-yloxybenzene;(2-methylpropan-2-yl)oxybenzene;methylsilane is sourced from PubChem (CID 160831441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).