trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane

C18H40O2Si4 — CID 134854197

About trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane

trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane (PubChem CID 134854197) has the molecular formula C18H40O2Si4 and a molecular weight of 400.86 g/mol. Its IUPAC name is trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane.

Molecular Properties

• Compound Name: trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane
• PubChem CID: 134854197
• Molecular Formula: C18H40O2Si4
• Molecular Weight: 400.86 g/mol
• Exact Mass: 400.21
• IUPAC Name: trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane
• SMILES: C=CCO[C@H](C=C)[C@@H](C=C)O[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
• InChI: InChI=1S/C18H40O2Si4/c1-13-16-19-17(14-2)18(15-3)20-24(21(4,5)6,22(7,8)9)23(10,11)12/h13-15,17-18H,1-3,16H2,4-12H3/t17-,18-/m1/s1
• InChIKey: AWXRLFSTYRQXLO-QZTJIDSGSA-N
• XLogP: 5.51
• TPSA: 18.46 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 11
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	400.86
LogP ≤ 5	5.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

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 trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane?

The IUPAC name of trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane (CID 134854197) is trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane.

What is the SMILES notation for trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane?

The canonical SMILES for trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane is C=CCO[C@H](C=C)[C@@H](C=C)O[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C.

What is the InChIKey of trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane?

The InChIKey is AWXRLFSTYRQXLO-QZTJIDSGSA-N. The full InChI is InChI=1S/C18H40O2Si4/c1-13-16-19-17(14-2)18(15-3)20-24(21(4,5)6,22(7,8)9)23(10,11)12/h13-15,17-18H,1-3,16H2,4-12H3/t17-,18-/m1/s1.

What are the key properties of trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane?

trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane has a molecular weight of 400.86 g/mol, XLogP of 5.51, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane is sourced from PubChem (CID 134854197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).