butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol

C26H58O9Si3 — CID 91532506

About butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol

butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol (PubChem CID 91532506) has the molecular formula C26H58O9Si3 and a molecular weight of 599.00 g/mol. Its IUPAC name is butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol.

Molecular Properties

• Compound Name: butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol
• PubChem CID: 91532506
• Molecular Formula: C26H58O9Si3
• Molecular Weight: 599.00 g/mol
• Exact Mass: 598.34
• IUPAC Name: butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol
• SMILES: C=CCOCC(O)COCC(O)COCC(O)COCC=C.CCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C
• InChI: InChI=1S/C15H28O7.C11H30O2Si3/c1-3-5-19-7-13(16)9-21-11-15(18)12-22-10-14(17)8-20-6-4-2;1-9-10-11-15(5,6)13-16(7,8)12-14(2,3)4/h3-4,13-18H,1-2,5-12H2;9-11H2,1-8H3
• InChIKey: YUSWAIGSCZKSCN-UHFFFAOYSA-N
• XLogP: 4.07
• TPSA: 116.07 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 9
• Rotatable Bonds: 23
• Heavy Atoms: 38
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	599.00
LogP ≤ 5	4.07
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol?

The IUPAC name of butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol (CID 91532506) is butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol.

What is the SMILES notation for butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol?

The canonical SMILES for butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol is C=CCOCC(O)COCC(O)COCC(O)COCC=C.CCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C.

What is the InChIKey of butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol?

The InChIKey is YUSWAIGSCZKSCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O7.C11H30O2Si3/c1-3-5-19-7-13(16)9-21-11-15(18)12-22-10-14(17)8-20-6-4-2;1-9-10-11-15(5,6)13-16(7,8)12-14(2,3)4/h3-4,13-18H,1-2,5-12H2;9-11H2,1-8H3.

What are the key properties of butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol?

butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol has a molecular weight of 599.00 g/mol, XLogP of 4.07, 23 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for butyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;1-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]-3-prop-2-enoxypropan-2-ol is sourced from PubChem (CID 91532506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).