but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol

C23H60O3Si4 — CID 167623484

About but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol

but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol (PubChem CID 167623484) has the molecular formula C23H60O3Si4 and a molecular weight of 497.07 g/mol. Its IUPAC name is but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol.

Molecular Properties

• Compound Name: but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol
• PubChem CID: 167623484
• Molecular Formula: C23H60O3Si4
• Molecular Weight: 497.07 g/mol
• Exact Mass: 496.36
• IUPAC Name: but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol
• SMILES: C=CCC.CCCC[Si](C)(C)O[Si](C)(C)CCCC.CCCO.C[SiH](C)O[SiH](C)C
• InChI: InChI=1S/C12H30OSi2.C4H14OSi2.C4H8.C3H8O/c1-7-9-11-14(3,4)13-15(5,6)12-10-8-2;1-6(2)5-7(3)4;1-3-4-2;1-2-3-4/h7-12H2,1-6H3;6-7H,1-4H3;3H,1,4H2,2H3;4H,2-3H2,1H3
• InChIKey: MTNUAGVDOVCXBQ-UHFFFAOYSA-N
• XLogP: 7.95
• TPSA: 38.69 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 12
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	497.07
LogP ≤ 5	7.95
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol?

The IUPAC name of but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol (CID 167623484) is but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol.

What is the SMILES notation for but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol?

The canonical SMILES for but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol is C=CCC.CCCC[Si](C)(C)O[Si](C)(C)CCCC.CCCO.C[SiH](C)O[SiH](C)C.

What is the InChIKey of but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol?

The InChIKey is MTNUAGVDOVCXBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H30OSi2.C4H14OSi2.C4H8.C3H8O/c1-7-9-11-14(3,4)13-15(5,6)12-10-8-2;1-6(2)5-7(3)4;1-3-4-2;1-2-3-4/h7-12H2,1-6H3;6-7H,1-4H3;3H,1,4H2,2H3;4H,2-3H2,1H3.

What are the key properties of but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol?

but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol has a molecular weight of 497.07 g/mol, XLogP of 7.95, 12 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for but-1-ene;butyl-[butyl(dimethyl)silyl]oxy-dimethylsilane;dimethylsilyloxy(dimethyl)silane;propan-1-ol is sourced from PubChem (CID 167623484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).